Crystallography, X-Ray

subject area of

2,6-diamino-5,8-diaza-7,9-dicarba-purine Academic Article
"Chiral amnesia" as a driving force for solid-phase homochirality Academic Article
... The tyranny of the lattice Academic Article
1-[2(R)-(2-amino-2-methylpropionylamino)-3-(1H-indol-3-yl)propionyl]- 3-benzylpiperidine-3(S)-carboxylic acid ethyl ester (L-163,540): a potent, orally bioavailable, and short-duration growth hormone secretagogue Academic Article
1.35 and 2.07 a resolution structures of the red abalone sperm lysin monomer and dimer reveal features involved in receptor binding Academic Article
1.4 A structure of photoactive yellow protein, a cytosolic photoreceptor: unusual fold, active site, and chromophore Academic Article
2,5-diaminopyrimidines and 3,5-disubstituted azapurines as inhibitors of glycogen synthase kinase-3 (GSK-3) Academic Article
2,6-diaminopurine in TNA: effect on duplex stabilities and on the efficiency of template-controlled ligations Academic Article
2-(6-Phenyl-1H-indazol-3-yl)-1H-benzo[d]imidazoles: Design and synthesis of a potent and isoform selective PKC-zeta inhibitor Academic Article
2-Amino- 1,2,4 triazolo 1,5-a pyridines as JAK2 inhibitors Academic Article
2-aminopyridines as highly selective inducible nitric oxide synthase inhibitors. Differential binding modes dependent on nitrogen substitution Academic Article
2.8 Å resolution reconstruction of the Thermoplasma acidophilum 20S proteasome using cryo-electron microscopy Academic Article
3'-Phosphoadenosine-5'-phosphosulfate reductase in complex with thioredoxin: a structural snapshot in the catalytic cycle Academic Article
3,5-disubstituted quinolines as novel c-Jun N-terminal kinase inhibitors Academic Article
3D domain swapping modulates the stability of members of an icosahedral virus group Academic Article
4-Aminoindazolyl-dihydrofuro 3,4-d pyrimidines as non-covalent inhibitors of mutant epidermal growth factor receptor tyrosine kinase Academic Article
4-Aminopyridyl-based CYP51 inhibitors as anti-Trypanosoma cruzi drug leads with improved pharmacokinetic profile and in vivo potency Academic Article
A Therapeutic Non-self-reactive SARS-CoV-2 Antibody Protects from Lung Pathology in a COVID-19 Hamster Model Academic Article
A biomimetically inspired synthesis of the dehydropiperidine domain of thiostrepton Academic Article
A bisubstrate analog induces unexpected conformational changes in phosphoglycerate kinase from trypanosoma brucei Academic Article
A chemical genomic analysis of decoquinate, a plasmodium falciparum cytochrome b inhibitor Academic Article
A comparative analysis of the immunological evolution of antibody 28B4 Academic Article
A comparison of the atomic model of F-actin with cryo-electron micrographs of actin and decorated actin Academic Article
A computationally designed inhibitor of an Epstein-Barr viral Bcl-2 protein induces apoptosis in infected cells Academic Article
A concise asymmetric total synthesis of aspidophytine Academic Article
A conformational switch in human immunodeficiency virus gp41 revealed by the structures of overlapping epitopes recognized by neutralizing antibodies Academic Article
A conservative isoleucine to leucine mutation causes major rearrangements and cold sensitivity in KlenTaq1 DNA polymerase Academic Article
A conserved XIAP-interaction motif in caspase-9 and Smac/DIABLO regulates caspase activity and apoptosis Academic Article
A conserved fold for fimbrial components revealed by the crystal structure of a putative fimbrial assembly protein (BT1062) from bacteroides thetaiotaomicron at 2.2 A resolution Academic Article
A copper(I)-catalyzed 1,2,3-triazole azide-alkyne click compound is a potent inhibitor of a multidrug-resistant HIV-1 protease variant Academic Article
A crystal structure of a model of the repeating r(CGG) transcript found in fragile X syndrome Academic Article
A density functional evaluation of an Fe(III)-Fe(IV) model diiron cluster: comparisons with ribonucleotide reductase intermediate X Academic Article
A discovery strategy for selective inhibitors of c-Src in complex with the focal adhesion kinase SH3/SH2-binding region Academic Article
A dynamic knockout reveals that conformational fluctuations influence the chemical step of enzyme catalysis Academic Article
A dynamic structural model of expanded RNA CAG repeats: A refined X-ray structure and computational investigations using molecular dynamics and umbrella sampling simulations Academic Article
A fence-like coat for the nuclear pore membrane Academic Article
A fluorinated ligand enables room-temperature and regioselective Pd-catalyzed fluorination of aryl triflates and bromides Academic Article
A force field with discrete displaceable waters and desolvation entropy for hydrated ligand docking Academic Article
A functional hot spot for antigen recognition in a superagonist TCR/MHC complex Academic Article
A genetically encoded diazirine photocrosslinker in Escherichia coli Academic Article
A glutamate switch controls voltage-sensitive phosphatase function Academic Article
A glutamate/aspartate switch controls product specificity in a protein arginine methyltransferase Academic Article
A helix replacement mechanism directs metavinculin functions Academic Article
A heterocyclic peptide nanotube Academic Article
A highly conserved cryptic epitope in the receptor binding domains of SARS-CoV-2 and SARS-CoV Academic Article
A highly conserved neutralizing epitope on group 2 influenza a viruses Academic Article
A highly diastereo- and enantioselective synthesis of multisubstituted cyclopentanes with four chiral carbons by the organocatalytic domino Michael-Henry reaction Academic Article
A highly effective nonpolar isostere of deoxyguanosine: synthesis, structure, stacking, and base pairing Academic Article
A highly stereoselective organocatalytic tandem aminoxylation/aza-Michael reaction for the synthesis of tetrahydro-1,2-oxazines Academic Article
A human tRNA synthetase is a potent PARP1-activating effector target for resveratrol Academic Article
A human-infecting H10N8 influenza virus retains a strong preference for avian-type receptors Academic Article
A hydrophobic pocket in the active site of glycolytic aldolase mediates interactions with Wiskott-Aldrich syndrome protein Academic Article
A major histocompatibility complex-peptide-restricted antibody and t cell receptor molecules recognize their target by distinct binding modes - crystal structure of human leukocyte antigen (hla)-a1-mage-a1 in complex with fab-hyb3 Academic Article
A maltose-binding protein fusion construct yields a robust crystallography platform for MCL1 Academic Article
A molecular dynamics simulation study of segment B1 of protein G Academic Article
A molecular switch regulating transcriptional repression and activation of PPARγ Academic Article
A mutational study of a Diels-Alderase catalytic antibody Academic Article
A new functional domain of guanine nucleotide dissociation inhibitor (alpha-gdi) involved in rab recycling Academic Article
A new method for the stereoselective synthesis of α- and β-glycosylamines using the burgess reagent Academic Article
A new regulatory switch in a JAK protein kinase Academic Article
A nonself sugar mimic of the hiv glycan shield shows enhanced antigenicity Academic Article
A novel achiral seco-amino-cyclopropylindoline (CI) analog of CC-1065 and the duocarmycins: design, synthesis and biological studies Academic Article
A novel adenylate binding site confers phosphopantetheine adenylyltransferase interactions with coenzyme A Academic Article
A novel cereblon modulator recruits GSPT1 to the CRL4(CRBN) ubiquitin ligase Academic Article
A novel cryoprotection scheme for enhancing the diffraction of crystals of recombinant cytochrome ba3 oxidase from thermus thermophilus Academic Article
A novel in silico approach to drug discovery via computational intelligence Academic Article
A novel processive mechanism for DNA synthesis revealed by structure, modeling and mutagenesis of the accessory subunit of human mitochondrial DNA polymerase Academic Article
A nucleotide-flipping mechanism from the structure of human uracil-DNA glycosylase bound to DNA Academic Article
A peptide inhibitor of hiv-1 neutralizing antibody 2g12 is not a structural mimic of the natural carbohydrate epitope on gp120 Academic Article
A peptide that antagonizes tcr-mediated reactions with both syngeneic and allogeneic agonists: Functional and structural aspects Academic Article
A potent and broad neutralizing antibody recognizes and penetrates the HIV glycan shield Academic Article
A pseudoatomic model of the dynamin polymer identifies a hydrolysis-dependent powerstroke Academic Article
A recurring motif for antibody recognition of the receptor-binding site of influenza hemagglutinin Academic Article
A reduced-amide inhibitor of Pin1 binds in a conformation resembling a twisted-amide transition state Academic Article
A remarkable ring contraction en route to the chartelline alkaloids Academic Article
A response regulatory protein with the site of phosphorylation blocked by an arginine interaction: Crystal structure of spo0f from bacillus subtilis Academic Article
A robotic system for crystallizing membrane and soluble proteins in lipidic mesophases Academic Article
A shared structural solution for neutralizing ebolaviruses Academic Article
A simple strategy towards membrane protein purification and crystallization Academic Article
A single amino acid change in the binding pocket alters specificity of an anti-integrin antibody AP7.4 as revealed by its crystal structure Academic Article
A single-domain llama antibody potently inhibits the enzymatic activity of botulinum neurotoxin by binding to the non-catalytic alpha-exosite binding region Academic Article
A small molecule RAS-mimetic disrupts RAS association with effector proteins to block signaling Academic Article
A specific cholesterol binding site is established by the 2.8 Å structure of the human β2-adrenergic receptor Academic Article
A stereoselective hydroamination transform to access polysubstituted indolizidines Academic Article
A structural basis for the regulatory inactivation of DnaA Academic Article
A structural framework for deciphering the link between I-A(g7) and autoimmune diabetes Academic Article
A structural model for the prostate disease marker, human prostate-specific antigen Academic Article
A structural snapshot of CYP2B4 in complex with paroxetine provides insights into ligand binding and clusters of conformational states Academic Article
A structurally distinct human mycoplasma protein that generically blocks antigen-antibody union Academic Article
A structured RNA motif locks Argonaute2:miR-122 onto the 5' end of the HCV genome Academic Article
A substrate mimic allows high-throughput assay of the FabA protein and consequently the identification of a novel inhibitor of pseudomonas aeruginosa FabA Academic Article
A surface on the androgen receptor that allosterically regulates coactivator binding Academic Article
A synthesis of the carbon skeleton of maoecrystal v Academic Article
A synthetic receptor for choline and carnitine Academic Article
A t14c variant of azotobacter vinelandii ferredoxin i undergoes facile 3fe-4s degrees to 4fe-4s (2+) conversion in vitro but not in vivo Academic Article
A total synthesis trilogy: Calicheamicin gamma 1i, taxol (r), and brevetoxin a Academic Article
A weak attractive interaction between organic fluorine and an amide group Academic Article
AG10 inhibits amyloidogenesis and cellular toxicity of the familial amyloid cardiomyopathy-associated V122I transthyretin Academic Article
ALG-2 divalent-ion affinity: Calorimetric analysis of the des23 versions reveals high-affinity site for Mg2+ Academic Article
ALS mutants of human superoxide dismutase form fibrous aggregates via framework destabilization Academic Article
ATP-directed capture of bioactive herbal-based medicine on human tRNA synthetase Academic Article
ATP-driven Rad50 conformations regulate DNA tethering, end resection, and ATM checkpoint signaling Academic Article
Abalone lysin: The dissolving and evolving sperm protein Academic Article
Acceleration of nucleophilic ch activation by strongly basic solvents Academic Article
Acidophilic adaptations in the structure of Acetobacter aceti N-5-carboxyaminoimidazole ribonucleotide mutase (PurE) Academic Article
Actin crystal dynamics: structural implications for F-actin nucleation, polymerization, and branching mediated by the anti-parallel dimer Academic Article
Active and alkylated human agt structures: A novel zinc site, inhibitor and extrahelical base binding Academic Article
Active and inhibited human catalase structures: Ligand and nadph binding and catalytic mechanism Academic Article
Active site binding modes of curcumin in HIV-1 protease and integrase Academic Article
Active site conformational changes of prostasin provide a new mechanism of protease regulation by divalent cations Academic Article
Active-site and oligosaccharide recognition residues of peptide-n-4-(n-acetyl-beta-d-glucosaminyl)asparagine amidase-f Academic Article
Adaptations for the oxidation of polycyclic aromatic hydrocarbons exhibited by the structure of human P450 1A2 Academic Article
Affinity maturation of a potent family of HIV antibodies is primarily focused on accommodating or avoiding glycans Academic Article
Aggregation propensities of superoxide dismutase G93 hotspot mutants mirror ALS clinical phenotypes Academic Article
Agonist-bound structure of the human P2Y(12) receptor Academic Article
Agonist-mediated conformational changes in acetylcholine-binding protein revealed by simulation and intrinsic tryptophan fluorescence Academic Article
Alanyl-tRNA synthetase crystal structure and design for acceptor-stem recognition Academic Article
Alexander Rich (1924-2015) Academic Article
Alkyltransferase-like protein (atl1) distinguishes alkylated guanines for DNA repair using cation-pi interactions Academic Article
Allosteric communication in the dynein motor domain Academic Article
Allosteric inhibition of human ribonucleotide reductase by dATP entails the stabilization of a hexamer Academic Article
Allosteric inhibition of hypoxia inducible factor-2 with small molecules Academic Article
Allosteric inhibition via R-state destabilization in ATP sulfurylase from Penicillium chrysogenum Academic Article
Altering substrate specificity at the heme edge of cytochrome c peroxidase Academic Article
Alternative conformations of a nucleic acid four-way junction Academic Article
Amino acid substitution at the dimeric interface of human manganese superoxide dismutase Academic Article
An Alternative Binding Mode of IGHV3-53 Antibodies to the SARS-CoV-2 Receptor Binding Domain Academic Article
An EB1-binding motif acts as a microtubule tip localization signal Academic Article
An S(N)Ar approach to sterically hindered ortho-alkoxybenzaldehydes for the synthesis of olefin metathesis catalysts Academic Article
An activated glutamate residue identified in photosystern II at the interface between the manganese-stabilizing subunit and the D2 polypeptide Academic Article
An alpha beta T cell receptor structure at 2.5 A and its orientation in the TCR-MHC complex Academic Article
An aminoquinazoline inhibitor of the essential bacterial cell wall synthetic enzyme GlmU has a unique non-protein-kinase-like binding mode Academic Article
An antagonist peptide epo receptor complex suggests that receptor dimerization is not sufficient for activation Academic Article
An antibody CDR3-erythropoietin fusion protein Academic Article
An antibody exo Diels-Alderase inhibitor complex at 1.95 Å resolution Academic Article
An aspartate and a water molecule mediate efficient acid-base catalysis in a tailored antibody pocket Academic Article
An atomic model AAA-ATPase/20S core particle sub-complex of the 26S proteasome Academic Article
An automated procedure for detecting protein folds from sub-nanometer resolution electron density Academic Article
An efficient platform for screening expression and crystallization of glycoproteins produced in human cells Academic Article
An electrostatic mechanism for Ca2+ -mediated regulation of gap junction channels Academic Article
An enantioselective synthesis of insecticidal 4-alkynyloxazolines Academic Article
An engineered transthyretin monomer that is nonamyloidogenic, unless it is partially denatured Academic Article
An escherichia coli-based cell-free system for large-scale production of functional mammalian membrane proteins suitable for x-ray crystallography Academic Article
An evolved aminoacyl-tRNA synthetase with atypical polysubstrate specificity Academic Article
An expedient synthesis of a functionalized core structure of bielschowskysin Academic Article
An improved monomeric infrared fluorescent protein for neuronal and tumour brain imaging Academic Article
An insight into the interaction mode between CheB and chemoreceptor from two crystal structures of CheB methylesterase catalytic domain Academic Article
An integrated chemical biology approach provides insight into Cdk2 functional redundancy and inhibitor sensitivity Academic Article
An ion selectivity filter in the extracellular domain of Cys-loop receptors reveals determinants for ion conductance Academic Article
An online resource for GPCR structure determination and analysis Academic Article
An open conformation of mammalian cytochrome P450 2B4 at 1.6-A resolution Academic Article
An unexpected outcome of surface engineering an integral membrane protein: Improved crystallization of cytochrome ba(3) from thermus thermophilus Academic Article
An unexpected twist in viral capsid maturation Academic Article
An unusual case of pseudo-merohedral twinning in orthorhombic crystals of Dicer Academic Article
An unusual mechanism of thymidylate biosynthesis in organisms containing the thyX gene Academic Article
An α/β-peptide helix bundle with a pure β3-amino acid core and a distinctive quaternary structure Academic Article
Analysis of PUGNAc and NAG-thiazoline as transition state analogues for human O-GlcNAcase: mechanistic and structural insights into inhibitor selectivity and transition state poise Academic Article
Analysis of hapten binding and catalytic determinants in a family of catalytic antibodies Academic Article
Analysis of the class i aldolase binding site architecture based on the crystal structure of 2-deoxyribose-5-phosphate aldolase at 0.99 Å resolution Academic Article
Anchored plasticity opens doors for selective inhibitor design in nitric oxide synthase Academic Article
Ancient tRNA synthetase meets modern structural biology Academic Article
Anion-exchange-triggered 1,3-shift of an NH proton to iridium in protic n-heterocyclic carbenes: Hydrogen-bonding and ion-pairing effects Academic Article
Antagonists of inhibitor of apoptosis proteins based on thiazole amide isosteres Academic Article
Antibodies to a conformational epitope on gp41 neutralize HIV-1 by destabilizing the Env spike Academic Article
Antibody 2g12 recognizes di-mannose equivalently in domain- and nondomain-exchanged forms but only binds the hiv-1 glycan shield if domain exchanged Academic Article
Antibody 8ANC195 reveals a site of broad vulnerability on the HIV-1 envelope spike Academic Article
Antibody binding defines a structure for an epitope that participates in the prpc -> prpsc conformational change Academic Article
Antibody catalysis of the oxidation of water Academic Article
Antibody domain exchange is an immunological solution to carbohydrate cluster recognition Academic Article
Antibody modeling assessment II. Structures and models Academic Article
Antibody recognition of a highly conserved influenza virus epitope Academic Article
Antibody recognition of the pandemic H1N1 Influenza virus hemagglutinin receptor binding site Academic Article
Anticipatory active-site motions and chromophore distortion prime photoreceptor PYP for light activation Academic Article
Antidiabetic phospholipid-nuclear receptor complex reveals the mechanism for phospholipid-driven gene regulation Academic Article
Antifungal azoles: structural insights into undesired tight binding to cholesterol-metabolizing CYP46A1 Academic Article
Antigen recognition by variable lymphocyte receptors Academic Article
Antitumor activity of a systemic STING-activating non-nucleotide cGAMP mimetic Academic Article
Apo raver1 structure reveals distinct RRM domain orientations Academic Article
Apo-human carbonic anhydrase II revisited: implications of the loss of a metal in protein structure, stability, and solvent network Academic Article
Architecture of the Soluble Receptor Aer2 Indicates an In-Line Mechanism for PAS and HAMP Domain Signaling Academic Article
Architecture of the complex formed by large and small terminase subunits from bacteriophage P22 Academic Article
Architecture of the flagellar rotor Academic Article
Architecture of the mediator head module Academic Article
Architectures of lipid transport systems for the bacterial outer membrane Academic Article
Artificial ligand binding within the HIF2α PAS-B domain of the HIF2 transcription factor Academic Article
Artificial protein cavities as specific ligand-binding templates: characterization of an engineered heterocyclic cation-binding site that preserves the evolved specificity of the parent protein Academic Article
Arylation of rhodium(II) azavinyl carbenes with boronic acids Academic Article
Asia growth in membrane protein structure Academic Article
Assembly of acanthamoeba myosin-ii minifilaments. Model of anti-parallel dimers based on em and x-ray diffraction of 2d and 3d crystals Academic Article
Assembly states of FliM and FliG within the flagellar switch complex Academic Article
Assembly-directed antivirals differentially bind quasiequivalent pockets to modify hepatitis B virus capsid tertiary and quaternary structure Academic Article
Asymmetric electrophilic fluorocyclization with carbon nucleophiles Academic Article
Asymmetric synthesis of 1,2,9,9a-tetrahydrocyclopropa[c]benzo[e]indol-4-one (CBI) Academic Article
Asymmetric synthesis of pochonin E and F, revision of their proposed structure, and their conversion to potent Hsp90 inhibitors Academic Article
Asymmetric synthesis of quaternary alpha- and beta-amino acids and beta-lactams via proline-catalyzed mannich reactions with branched aldehyde donors Academic Article
Atl1 regulates choice between global genome and transcription-coupled repair of o-6-alkylguanines Academic Article
Atomic and residue hydrophilicity in the context of folded protein structures Academic Article
Atomic structure of the 75 MDa extremophile Sulfolobus turreted icosahedral virus determined by CryoEM and X-ray crystallography Academic Article
Atomic-level modelling of the HIV capsid Academic Article
AutoDock4(Zn): an improved AutoDock force field for small-molecule docking to zinc metalloproteins Academic Article
AutoDrug: fully automated macromolecular crystallography workflows for fragment-based drug discovery Academic Article
Automated docking of ligands to an artificial active site: augmenting crystallographic analysis with computer modeling Academic Article
Automated identification of functional dynamic contact networks from X-ray crystallography Academic Article
Automated sample mounting and alignment system for biological crystallography at a synchrotron source Academic Article
Automated three-dimensional reconstruction of keyhole limpet hemocyanin type 1 Academic Article
Automation of x-ray crystallography Academic Article
Azotobacter vinelandii ferredoxin i - a sequence and structure comparison approach to alteration of 4fe-4s 2(+/+) reduction potential Academic Article
Azotobacter-vinelandii ferredoxin-i - alteration of individual surface-charges and the 4fe-4s (2+/+) cluster reduction potential Academic Article
Azotobacter-vinelandii ferredoxin-i - aspartate-15 facilitates proton-transfer to the reduced 3fe-4s cluster Academic Article
Azurin as a protein scaffold for a low-coordinate nonheme iron site with a small-molecule binding pocket Academic Article
Bacterial chemoreceptor arrays are hexagonally packed trimers of receptor dimers networked by rings of kinase and coupling proteins Academic Article
Bacterial pleckstrin homology domains: A prokaryotic origin for the PH domain Academic Article
Balancing target flexibility and target denaturation in computational fragment-based inhibitor discovery Academic Article
Base excision repair enzyme family portrait: Integrating the structure and chemistry of an entire DNA repair pathway Academic Article
Base excision repair initiation revealed by crystal structures and binding kinetics of human uracil-DNA glycosylase with DNA Academic Article
Benzazepinones and benzoxazepinones as antagonists of inhibitor of apoptosis proteins (IAPs) selective for the second baculovirus IAP repeat (BIR2) domain Academic Article
Benzoxazoles as transthyretin amyloid fibril inhibitors: Synthesis, evaluation, and mechanism of action Academic Article
Biggest virus molecular structure yet! Academic Article
Binding and inactivation mechanism of a humanized fatty acid amide hydrolase by alpha-ketoheterocycle inhibitors revealed from cocrystal structures Academic Article
Binding mode and potency of N-indolyloxopyridinyl-4-aminopropanyl-based inhibitors targeting Trypanosoma cruzi CYP51 Academic Article
Biochemical and structural evaluation of highly selective 2-arylbenzoxazole-based transthyretin amyloidogenesis inhibitors Academic Article
Biochemical characterization and crystal structure of a dim1 family associated protein: Dim2 Academic Article
Biochemical characterization and structural analysis of a highly proficient cocaine esterase Academic Article
Biogenesis of the secretory granule: Chromogranin a coiled-coil structure results in unusual physical properties and suggests a mechanism for granule core condensation Academic Article
Biomimetic synthesis of antimalarial naphthoquinones Academic Article
Biophysical characterization of a β-peptide bundle: Comparison to natural proteins Academic Article
Bisaryloxime ethers as potent inhibitors of transthyretin amyloid fibril formation Academic Article
Bistable cucurbituril rotaxanes without stoppers Academic Article
Blocking effect and crystal structure of natrin toxin, a cysteine-rich secretory protein from naja atra venom that targets the BKCa channel Academic Article
Blu-ice and the distributed control system: Software for data acquisition and instrument control at macromolecular crystallography beamlines Academic Article
Blue-fluorescent antibodies Academic Article
Breaking cryo-EM resolution barriers to facilitate drug discovery Academic Article
Breaking the low barrier hydrogen bond in a serine protease Academic Article
Broadly neutralizing anti-hiv antibody 4e10 recognizes a helical conformation of a highly conserved fusion-associated motif in gp41 Academic Article
Broadly neutralizing antibody PGT121 allosterically modulates CD4 binding via recognition of the HIV-1 gp120 V3 base and multiple surrounding glycans Academic Article
Broken symmetry DFT calculations/analysis for oxidized and reduced dinuclear center in cytochrome c oxidase: relating structures, protonation states, energies, and Mössbauer properties in ba3 thermus thermophilus Academic Article
Brush border myosin-i structure and adp-dependent conformational changes revealed by cryoelectron microscopy and image analysis Academic Article
C-2-symmetrical tetrahydroxyazepanes as inhibitors of glycosidases and hiv/fiv proteases Academic Article
Calculations of electrostatic interactions and pK(a)s in the active site of Escherichia coli thioredoxin Academic Article
Capsid conformational sampling in HK97 maturation visualized by X-ray crystallography and cryo-EM Academic Article
Carbon-deuterium bonds as probes of dihydrofolate reductase Academic Article
Carbonic anhydrase inhibitors. Interaction of 2-n,n-dimethylamino-1,3,4-thiadiazole-5-methanesulfonamide with 12 mammalian isoforms: Kinetic and x-ray crystallographic studies Academic Article
Catalysis of decarboxylation by a preorganized heterogeneous microenvironment: Crystal structures of abzyme 21D8 Academic Article
Catalytic and structural effects of amino acid substitution at histidine 30 in human manganese superoxide dismutase: Insertion of valine Cγ into the substrate access channel Academic Article
Catalytic antibodies - structure and function Academic Article
Catalytic asymmetric formal [4 + 1] annulation leading to optically active cis-isoxazoline N-oxides Academic Article
Catch and Anchor Approach To Combat Both Toxicity and Longevity of Botulinum Toxin A Academic Article
Cavitand-porphyrins Academic Article
Cbp/p300 taz1 domain forms a structured scaffold for ligand binding Academic Article
Changes in active site histidine hydrogen bonding trigger cryptochrome activation Academic Article
Characterization and inactivation of an agmatine deiminase from helicobacter pylori Academic Article
Characterization and optimization of selective, nonpeptidic inhibitors of cathepsin S with an unprecedented binding mode Academic Article
Characterization of a factor Xa binding site on factor Va near the Arg-506 activated protein C cleavage site Academic Article
Characterization of native protein complexes using ultraviolet photodissociation mass spectrometry Academic Article
Characterization of selective exosite-binding inhibitors of matrix metalloproteinase 13 that prevent articular cartilage degradation in vitro Academic Article
Characterization of the electrophile binding site and substrate binding mode of the 26-kda glutathione s-transferase from schistosoma japonicum Academic Article
Characterization of thien-2-yl 1S,2R-milnacipran analogues as potent norepinephrine/serotonin transporter inhibitors for the treatment of neuropathic pain Academic Article
Characterization of y122f r2 of escherichia coli ribonucleotide reductase by time-resolved physical biochemical methods and x-ray crystallography Academic Article
Characterizing flexible and intrinsically unstructured biological macromolecules by sas using the porod-debye law Academic Article
Charting a path to success in virtual screening Academic Article
Chasing molecules that were never there: Misassigned natural products and the role of chemical synthesis in modern structure elucidation Academic Article
Chemical and structural analysis of an antibody folding intermediate trapped during glycan biosynthesis Academic Article
Chemical modification of viruses and virus-like particles Academic Article
Chemical tools for studying the impact of cis/trans prolyl isomerization on signaling: a case study on RNA polymerase II phosphatase activity and specificity Academic Article
Chemical tools to decipher regulation of phosphatases by proline isomerization on eukaryotic RNA polymerase II Academic Article
Chemoenzymatic synthesis of GDP-L-fucose and the Lewis X glycan derivatives Academic Article
Chemoproteomics demonstrates target engagement and exquisite selectivity of the clinical phosphodiesterase 10A inhibitor MP-10 in its native environment Academic Article
Chemoselective small molecules that covalently modify one lysine in a non-enzyme protein in plasma Academic Article
Chemotype-selective modes of action of κ-opioid receptor agonists Academic Article
Cheshift-2 resolves a local inconsistency between two x-ray crystal structures Academic Article
Chimeragenesis of distantly-related proteins by noncontiguous recombination Academic Article
Chiral Brønsted acid catalyzed enantioselective addition of alpha-isocyanoacetamides to aldehydes Academic Article
Chirality holds the key for potent inhibition of the botulinum neurotoxin serotype A protease Academic Article
Chlamydia interfere with an interaction between the mannose-6-phosphate receptor and sorting nexins to counteract host restriction Academic Article
Chromodomain antagonists that target the polycomb-group methyllysine reader protein chromobox homolog 7 (CBX7) Academic Article
Cis-Amide isosteric replacement in thienobenzoxepin inhibitors of PI3-kinase Academic Article
Closely related antibody receptors exploit fundamentally different strategies for steroid recognition Academic Article
Co-evolution of a broadly neutralizing HIV-1 antibody and founder virus Academic Article
Co-folding of a FliF-FliG split domain forms the basis of the MS:C ring interface within the bacterial flagellar motor Academic Article
Coaxing a pyridine nucleus to give up its aromaticity: synthesis and pharmacological characterization of novel conformationally restricted analogues of nicotine and anabasine Academic Article
Cofactor-containing antibodies: Crystal structure of the original yellow antibody Academic Article
Coiled coils at the edge of configurational heterogeneity. Structural analyses of parallel and antiparallel homotetrameric coiled coils reveal configurational sensitivity to a single solvent-exposed amino acid substitution Academic Article
Combinatorial crystallization of an rna-protein complex Academic Article
Combined microspectrophotometric and crystallographic examination of chemically reduced and x-ray radiation-reduced forms of cytochrome ba(3) oxidase from thermus thermophilus: Structure of the reduced form of the enzymes Academic Article
Combined pseudo-merohedral twinning, non-crystallographic symmetry and pseudo-translation in a monoclinic crystal form of the gamma delta t-cell ligand t10 Academic Article
Combining h/d exchange mass spectroscopy and computational docking reveals extended DNA-binding surface on uracil-DNA glycosylase Academic Article
Community-wide assessment of GPCR structure modelling and ligand docking: GPCR Dock 2008 Academic Article
Comparative structural analysis of a novel glutathione S-transferase (ATU5508) from Agrobacterium tumefaciens at 2.0 Å resolution Academic Article
Comparative studies of T=3 and T=4 icosahedral RNA insect viruses Academic Article
Comparison of NMR and crystal structures for the proteins TM1112 and TM1367 Academic Article
Comparison of NMR and crystal structures highlights conformational isomerism in protein active sites Academic Article
Complementary approaches to structure determination of icosahedral viruses Academic Article
Complete epitopes for vaccine design derived from a crystal structure of the broadly neutralizing antibodies PGT128 and 8ANC195 in complex with an HIV-1 Env trimer Academic Article
Complete structural model of Escherichia coli RNA polymerase from a hybrid approach Academic Article
Computation-guided backbone grafting of a discontinuous motif onto a protein scaffold Academic Article
Computational design of epitope-scaffolds allows induction of antibodies specific for a poorly immunogenic hiv vaccine epitope Academic Article
Computational design of high-affinity epitope scaffolds by backbone grafting of a linear epitope Academic Article
Computational fragment-based binding site identification by ligand competitive saturation Academic Article
Computational protein design using flexible backbone remodeling and resurfacing: case studies in structure-based antigen design Academic Article
Conformational adaptation of human cytochrome p450 2b6 and rabbit cytochrome p450 2b4 revealed upon binding multiple amlodipine molecules Academic Article
Conformational analysis of galanin using end to end distance distribution observed by Förster resonance energy transfer Academic Article
Conformational change in the nadp(h) binding domain of transhydrogenase defines four states Academic Article
Conformational change upon product binding to Klebsiella pneumoniae UDP-glucose dehydrogenase: A possible inhibition mechanism for the key enzyme in polymyxin resistance Academic Article
Conformational changes associated with cofactor/substrate binding of 6-phosphogluconate dehydrogenase from Escherichia coli and Klebsiella pneumoniae: implications for enzyme mechanism Academic Article
Conformational changes associated with the binding of zinc acetate at the putative active site of XcTcmJ, a cupin from Xanthomonas Campestris pv. Campestris Academic Article
Conformational changes in nitric oxide synthases induced by chlorzoxazone and nitroindazoles: crystallographic and computational analyses of inhibitor potency Academic Article
Conformational differences between the wild type and V30M mutant transthyretin modulate its binding to genistein: implications to tetramer stability and ligand-binding Academic Article
Conformational diversity in nad(h) and interacting transhydrogenase nicotinamide nucleotide binding domains Academic Article
Conformational flexibility in crystal structures of human 11 β-hydroxysteroid dehydrogenase type I provide insights into glucocorticoid interconversion and enzyme regulation Academic Article
Conformational flexibility in the flap domains of ligand-free HIV protease Academic Article
Conformational flexibility of b-DNA at 0.74 Å resolution: D(ccagtactgg)(2) Academic Article
Conformational flexibility underlies ubiquitin ligation mediated by the WWP1HECT domain E3 ligase Academic Article
Conformational heterogeneity and the affinity of substrate molecular recognition by cytochrome P450cam Academic Article
Conformational isomerism can limit antibody catalysis Academic Article
Conformational polymorphism of cyclosporine-a Academic Article
Conformational states of cytochrome p450cam revealed by trapping of synthetic molecular wires Academic Article
Conformational switching in the fungal light sensor vivid Academic Article
Conformational transitions that enable histidine kinase autophosphorylation and receptor array integration Academic Article
Conformationally homogeneous heterocyclic pseudotetrapeptides as three-dimensional scaffolds for rational drug design: Receptor-selective somatostatin analogues Academic Article
Conquer by cryo-EM without physically dividing Academic Article
Conserved and heterogeneous lipid antigen specificities of CD1d-restricted NKT cell receptors Academic Article
Conserved binding mode of human beta(2) adrenergic receptor inverse agonists and antagonist revealed by X-ray crystallography Academic Article
Conserved glycine 232 in the ligand channel of ba(3) cytochrome oxidase from Thermus thermophilus Academic Article
Conserved structural chemistry for incision activity in structurally non-homologous apurinic/apyrimidinic endonuclease APE1 and endonuclease IV DNA repair enzymes Academic Article
Conserved xpb core structure and motifs for DNA unwinding: Implications for pathway selection of transcription or excision repair Academic Article
Constraints on the Radical Cation Center of Cytochrome c Peroxidase for Electron Transfer from Cytochrome c Academic Article
Construction of highly functionalized medium-sized rings: Synthesis of hyperforin and perforatumone model systems Academic Article
Construction of substituted N-hydroxyindoles: synthesis of a nocathiacin I model system Academic Article
Contrasting IgG structures reveal extreme asymmetry and flexibility Academic Article
Contribution of human manganese superoxide dismutase tyrosine 34 to structure and catalysis Academic Article
Contributions of ionic interactions and protein dynamics to cytochrome P450 2D6 (CYP2D6) substrate and inhibitor binding Academic Article
Control of four stereocenters in an organocatalytic domino double Michael reaction: Efficient synthesis of multisubstituted cyclopentanes Academic Article
Controlling conformational flexibility of an O(2)-binding H-NOX domain Academic Article
Conversion of a disulfide bond into a thioacetal group during echinomycin biosynthesis Academic Article
Copper-based pulsed dipolar ESR spectroscopy as a probe of protein conformation linked to disease states Academic Article
Copper-free cycloaddition of azide and alkyne in crystalline state facilitated by arene-perfluoroarene interactions Academic Article
Core structure of the yeast spt4-spt5 complex: A conserved module for regulation of transcription elongation Academic Article
Corticotropin-releasing hormone receptor antagonists: framework design and synthesis guided by ligand conformational studies Academic Article
Cortistatin a is a high-affinity ligand of protein kinases rock, cdk8, and cdk11 Academic Article
Coupled redox potentials in manganese and iron superoxide dismutases from reaction kinetics and density functional/electrostatics calculations Academic Article
Coupling of hydrogen bonding to chromophore conformation and function in photoactive yellow protein Academic Article
Cross-neutralization of influenza a viruses mediated by a single antibody loop Academic Article
Crosslinking of and coupling to viral capsid proteins by tyrosine oxidation Academic Article
Cryo-EM reveals a novel octameric integrase structure for betaretroviral intasome function Academic Article
Cryo-EM structure of a native, fully glycosylated, cleaved HIV-1 envelope trimer Academic Article
Cryo-EM structures and atomic model of the HIV-1 strand transfer complex intasome Academic Article
Crystal and solution structures of an HslUV protease-chaperone complex Academic Article
Crystal structure and activity studies of the C11 cysteine peptidase from parabacteroides merdae in the human gut microbiome Academic Article
Crystal structure and mechanism of tryptophan 2,3-dioxygenase, a heme enzyme involved in tryptophan catabolism and in quinolinate biosynthesis Academic Article
Crystal structure and modeling of the tetrahedral intermediate state of methylmalonate-semialdehyde dehydrogenase (MMSDH) from Oceanimonas doudoroffii Academic Article
Crystal structure and novel recognition motif of rho adp-ribosylating c3 exoenzyme from clostridium botulinum: Structural insights for recognition specificity and catalysis Academic Article
Crystal structure and site-specific mutagenesis of pterin-bound human phenylalanine hydroxylase Academic Article
Crystal structure of 2-phosphosulfolactate phosphatase (ComB) from Clostridium acetobutylicum at 2.6 Å resolution reveals a new fold with a novel active site Academic Article
Crystal structure of 3-hydroxyanthranilic acid 3,4-dioxygenase from saccharomyces cerevisiae: A special subgroup of the type III extradiol dioxygenases Academic Article
Crystal structure of AICAR transformylase IMP cyclohydrolase (TM1249) from Thermotoga maritima at 1.88 Å resolution Academic Article
Crystal structure of ATP sulfurylase from the bacterial symbiont of the hydrothermal vent tubeworm Riftia pachyptila Academic Article
Crystal structure of CYP24A1, a mitochondrial cytochrome P450 involved in vitamin D metabolism Academic Article
Crystal structure of Lsm3 octamer from Saccharomyces cerevisiae: Implications for Lsm ring organisation and recruitment Academic Article
Crystal structure of MHC class II I-Ab in complex with a human CLIP peptide: prediction of an I-Ab peptide-binding motif Academic Article
Crystal structure of Marburg virus VP24 Academic Article
Crystal structure of Marburg virus VP40 reveals a broad, basic patch for matrix assembly and a requirement of the N-terminal domain for immunosuppression Academic Article
Crystal structure of MraY, an essential membrane enzyme for bacterial cell wall synthesis Academic Article
Crystal structure of MtnX phosphatase from Bacillus subtilis at 2.0 Å resolution provides a structural basis for bipartite phosphomonoester hydrolysis of 2-hydroxy3-keto-5-methylthiopentenyl-1-phosphate Academic Article
Crystal structure of NMA 1982 from Neisseria meningiddis at 1.5 Å resolution provides a structural scaffold for nonclassical, eukaryotic-like phosphatases Academic Article
Crystal structure of NMC-4 fab anti-von Willebrand factor A1 domain Academic Article
Crystal structure of O-acetylserine sulfhydrylase (TM0665) from Thermotoga maritima at 1.8 A resolution Academic Article
Crystal structure of PG16 and chimeric dissection with somatically related PG9: structure-function analysis of two quaternary-specific antibodies that effectively neutralize HIV-1 Academic Article
Crystal structure of Pasteurella haemolytica ferric ion-binding protein a reveals a novel class of bacterial iron-binding proteins Academic Article
Crystal structure of S-adenosylmethionine : tRNA ribosyltransferase-isomerase (QueA) from Thermotoga maritima at 2.0 A resolution reveals a new fold Academic Article
Crystal structure of Saccharomyces cerevisiae 6-phosphogluconate dehydrogenase Gnd1 Academic Article
Crystal structure of Ssu72, an essential eukaryotic phosphatase specific for the C-terminal domain of RNA polymerase II, in complex with a transition state analogue Academic Article
Crystal structure of TM1030 from THermotoga maritima at 2.3 Å resolution reveals molecular details of its transcription repressor function Academic Article
Crystal structure of TM1367 from Thermotoga maritima at 1.90 Å resolution reveals an atypical member of the cyclophilin (peptidylprolyl isomerase) fold Academic Article
Crystal structure of Trbp111: a structure-specific tRNA-binding protein Academic Article
Crystal structure of UbiX, an aromatic acid decarboxylase from the psychrophilic bacterium Colwellia psychrerythraea that undergoes FMN-induced conformational changes Academic Article
Crystal structure of a B-form DNA duplex containing (L)-alpha-threofuranosyl (3 '-> 2 ') nucleosides: A four-carbon sugar is easily accommodated into the backbone of DNA Academic Article
Crystal structure of a PIN (PilT N-terminus) domain (AF0591) from Archaeoglobus fulgidus at 1.90 A resolution Academic Article
Crystal structure of a bacterial cocaine esterase Academic Article
Crystal structure of a bifunctional deaminase and reductase from Bacillus subtilis involved in riboflavin biosynthesis Academic Article
Crystal structure of a bifunctional transformylase and cyclohydrolase enzyme in purine biosynthesis Academic Article
Crystal structure of a biosynthetic sulfo-hirudin complexed to thrombin Academic Article
Crystal structure of a cocaine-binding antibody Academic Article
Crystal structure of a conserved hypothetical protein (gi : 13879369) from Mouse at 1.90 A resolution reveals a new fold Academic Article
Crystal structure of a cytochrome P450 2B6 genetic variant in complex with the inhibitor 4-(4-chlorophenyl)imidazole at 2.0-A resolution Academic Article
Crystal structure of a divalent metal ion transporter CorA at 2.9 Å resolution Academic Article
Crystal structure of a formiminotetrahydrofolate cyclodeaminase (TM1560) from Thermotoga maritima at 2.80 A resolution reveals a new fold Academic Article
Crystal structure of a fully glycosylated HIV-1 gp120 core reveals a stabilizing role for the glycan at Asn262 Academic Article
Crystal structure of a gamma delta t cell receptor ligand t22: A truncated mhc-like fold Academic Article
Crystal structure of a glycerate kinase (TM1585) from Thermotoga maritima at 2.70 Å resolution reveals a new fold Academic Article
Crystal structure of a glycerophosphodiester phosphodiesterase (GDPD) from Thermotoga maritima (TM1621) at 1.60 Å resolution Academic Article
Crystal structure of a human aminoacyl-tRNA synthetase cytokine Academic Article
Crystal structure of a human peptidyl-tRNA hydrolase reveals a new fold and suggests basis for a bifunctional activity Academic Article
Crystal structure of a lipid G protein-coupled receptor Academic Article
Crystal structure of a methionine aminopeptidase (TM1478) from Thermotoga maritima at 1.9 A resolution Academic Article
Crystal structure of a monomeric form of severe acute respiratory syndrome coronavirus endonuclease nsp15 suggests a role for hexamerization as an allosteric switch Academic Article
Crystal structure of a neutralizing human IGG against HIV-1: a template for vaccine design Academic Article
Crystal structure of a novel Sm-like protein of putative cyanophage origin at 2.60 Å resolution Academic Article
Crystal structure of a novel archaeal AAA plus ATPase SSO 1545 from Sulfolobus solfataricus Academic Article
Crystal structure of a phosphatase-resistant mutant of sporulation response regulator spo0f from bacillus subtilis Academic Article
Crystal structure of a phosphoribosylaminoimidazole mutase PurE (TM0446) from Thermotoga maritima at 1.77 Å resolution Academic Article
Crystal structure of a putative NADPH-dependent oxidoreductase (GI : 18204011) from mouse at 2.10 Å resolution Academic Article
Crystal structure of a putative PII-like signaling protein (TM0021) from Thermotoga maritima at 2.5 Å resolution Academic Article
Crystal structure of a putative glutamine amido transferase (TM1158) from Thermotoga maritima at 1.7 Å resolution Academic Article
Crystal structure of a putative modulator of DNA gyrase (pmbA) from Thermotoga maritima at 1.95 Å resolution reveals a new fold Academic Article
Crystal structure of a putative oxalate decarboxylase (TM1287) from Thermotoga maritima at 1.95 A resolution Academic Article
Crystal structure of a putative quorum sensing-regulated protein (PA3611) from the Pseudomonas-specific DUF4146 family Academic Article
Crystal structure of a ribose-5-phosphate isomerase RpiB (TM1080) from Thermotoga maritima at 1.90 Å resolution Academic Article
Crystal structure of a shark single-domain antibody v region in complex with lysozyme Academic Article
Crystal structure of a single-stranded DNA-binding protein (TM0604) from Thermotoga maritima at 2.60 a resolution Academic Article
Crystal structure of a soluble cleaved HIV-1 envelope trimer Academic Article
Crystal structure of a transcription regulator (TM1602) from Thermotoga maritima at 2.3 Å resolution Academic Article
Crystal structure of a two-subunit TrkA octameric gating ring assembly Academic Article
Crystal structure of a type II quinolic acid phosphoribosyltransferase (TM1645) from Thermotoga maritima at 2.50 Å resolution Academic Article
Crystal structure of a zinc-containing glycerol dehydrogenase (TM0423) from Thermotoga maritima at 1.5 Å resolution Academic Article
Crystal structure of adenosine 5 '-phosphosulfate kinase from Penicillium chrysogenum Academic Article
Crystal structure of an ADP-ribosylated protein with a cytidine deaminase-like fold, but unknown function (TM 1506), from Thermatoga maritima at 2.70 Å resolution Academic Article
Crystal structure of an Apo mRNA decapping enzyme (DcpS) from mouse at 1.83 Å resolution Academic Article
Crystal structure of an FIV/HIV chimeric protease complexed with the broad-based inhibitor, TL-3 Academic Article
Crystal structure of an HEPN domain protein (TM0613) from Thermotoga maritima at 1.75 Å resolution Academic Article
Crystal structure of an ORFan protein (TM1622) from Thermotoga maritima at 1.75 Å resolution reveals a fold similar to the Ran-binding protein Mog1p Academic Article
Crystal structure of an Udp-n-acetylmuramate-alanine ligase MurC (TM0231) from Thermotoga maritima at 2.3 Å resolution Academic Article
Crystal structure of an alanine-glyoxylate aminotransferase from anabaena sp at 1.70 A resolution reveals a noncovalently linked PLP cofactor Academic Article
Crystal structure of an allantoicase (YIR029W) from Saccharomyces cerevisiae at 2.4 Å resolution Academic Article
Crystal structure of an alpha/beta serine hydrolase (YDR428C) from Saccharomyces cerevisiae at 1.85 Å resolution Academic Article
Crystal structure of an aspartate aminotransferase (TM1255) from Thermotoga maritima at 1.90 Å resolution Academic Article
Crystal structure of an indigoidine synthase A (IndA)-like protein (TM64) from Thermotoga maritima at 1.90 A resolution reveals a new fold Academic Article
Crystal structure of an intact human IgG: antibody asymmetry, flexibility, and a guide for HIV-1 vaccine design Academic Article
Crystal structure of an iron-containing 1,3-propanediol dehydrogenase (TM0920) from Thermotoga maritima at 1.3 Å resolution Academic Article
Crystal structure of an isolated V(alpha) domain of the 2C T-cell receptor Academic Article
Crystal structure of an mhc class i presented glycopeptide that generates carbohydrate-specific ctl Academic Article
Crystal structure of an orphan protein (TM0875) from thermotoga maritima at 2.00 Å resolution reveals a new fold Academic Article
Crystal structure of antagonist bound human lysophosphatidic acid receptor 1 Academic Article
Crystal structure of aplysia adp ribosyl cyclase, a homologue of the bifunctional ectozyme cd38 Academic Article
Crystal structure of archaeal ribonuclease P protein aRpp29 from Archaeoglobus fulgidus Academic Article
Crystal structure of atp sulfurylase from penicillium chrysogenum: Insights into the allosteric regulation of sulfate assimilation Academic Article
Crystal structure of avian aminoimidazole-4-carboxamide ribonucleotide transformylase in complex with a novel non-folate inhibitor identified by virtual ligand screening Academic Article
Crystal structure of botulinum neuro-toxin type a and implications for toxicity Academic Article
Crystal structure of botulinum neurotoxin type a in complex with the cell surface co-receptor gt1b - insight into the toxin-neuron interaction Academic Article
Crystal structure of botulinum neurotoxin type g light chain: Serotype divergence in substrate recognition Academic Article
Crystal structure of fatty acid amide hydrolase bound to the carbamate inhibitor urb597: Discovery of a deacylating water molecule and insight into enzyme inactivation Academic Article
Crystal structure of full-length Zika virus NS5 protein reveals a conformation similar to Japanese encephalitis virus NS5 Academic Article
Crystal structure of gamma-glutamyl phosphate reductase (TM0293) from Thermotoga maritima at 2.0 Å resolution Academic Article
Crystal structure of histidine phosphotransfer protein ShpA, an essential regulator of stalk biogenesis in Caulobacter crescentus Academic Article
Crystal structure of homoserine o-succinyltransferase from bacillus cereus at 2.4 Å resolution Academic Article
Crystal structure of hsiuv complexed with a vinyl sulfone inhibitor: Corroboration of a proposed mechanism of allosteric activation of hsiv by hsiu Academic Article
Crystal structure of human adenovirus at 3.5 Å resolution Academic Article
Crystal structure of human antibody 2909 reveals conserved features of quaternary structure-specific antibodies that potently neutralize HIV-1 Academic Article
Crystal structure of human carboxylesterase 1 complexed with the Alzheimer's drug tacrine: from binding promiscuity to selective inhibition Academic Article
Crystal structure of human cytochrome p450 2d6 with prinomastat bound Academic Article
Crystal structure of human glyoxalase I--evidence for gene duplication and 3D domain swapping Academic Article
Crystal structure of human glyoxalase II and its complex with a glutathione thiolester substrate analogue Academic Article
Crystal structure of human ornithine transcarbamylase complexed with carbamoyl phosphate and L-norvaline at 1.9 A resolution Academic Article
Crystal structure of human seryl-tRNA synthetase and Ser-SA complex reveals a molecular lever specific to higher eukaryotes Academic Article
Crystal structure of human toll-like receptor 3 (tlr3) ectodomain Academic Article
Crystal structure of human triggering receptor expressed on myeloid cells 1 (TREM-1) at 1.47 A Academic Article
Crystal structure of human vacuolar protein sorting protein 29 reveals a phosphodiesterase/nuclease-like fold and two protein-protein interaction sites Academic Article
Crystal structure of human vinculin Academic Article
Crystal structure of misoprostol bound to the labor inducer prostaglandin E-2 receptor Academic Article
Crystal structure of mouse cd1: An mhc-like fold with a large hydrophobic binding groove Academic Article
Crystal structure of mouse cd1d bound to the self ligand phosphatidylcholine: A molecular basis for nkt cell activation Academic Article
Crystal structure of mouse triggering receptor expressed on myeloid cells 1 (trem-1) at 1.76 Å Academic Article
Crystal structure of nonstructural protein 10 from the severe acute respiratory syndrome coronavirus reveals a novel fold with two zinc-binding motifs Academic Article
Crystal structure of phosphoribosylformyl-glycinamidine synthase II, PurS subunit (TM1244) from thermotoga maritima at 1.90 Å resolution Academic Article
Crystal structure of phosphoribosylformylglycinamidine synthase II (smPurL) from Thermotoga maritima at 2.15 Å-resolution Academic Article
Crystal structure of rhodopsin bound to arrestin by femtosecond X-ray laser Academic Article
Crystal structure of soluble md-1 and its interaction with lipid iva Academic Article
Crystal structure of staphylococcus aureus transglycosylase in complex with a lipid ii analog and elucidation of peptidoglycan synthesis mechanism Academic Article
Crystal structure of tetrameric form of human lysyl-tRNA synthetase: implications for multisynthetase complex formation Academic Article
Crystal structure of the 100 kda arsenite oxidase from alcaligenes faecalis in two crystal forms at 1.64 Å and 2.03 Å Academic Article
Crystal structure of the ALK (anaplastic lymphoma kinase) catalytic domain Academic Article
Crystal structure of the ApbE protein (TM1553) from Thermotoga maritima at 1.58 Å resolution Academic Article
Crystal structure of the C-terminal domain of mouse TLR9 Academic Article
Crystal structure of the DNA-recognition component of the bacterial virus sf6 genome-packaging machine Academic Article
Crystal structure of the Drosophila peptidoglycan recognition protein (PGRP)-SA at 1.56 A resolution Academic Article
Crystal structure of the Fic (Filamentation induced by cAMP) family protein SO4266 (gi|24375750) from Shewanella oneidensis MR-1 at 1.6 A resolution Academic Article
Crystal structure of the Formin mDia1 in autoinhibited conformation Academic Article
Crystal structure of the Frizzled 4 receptor in a ligand-free state Academic Article
Crystal structure of the HIV neutralizing antibody 2G12 in complex with a bacterial oligosaccharide analog of mammalian oligomannose Academic Article
Crystal structure of the N-terminal domains of the surface cell antigen 4 of Rickettsia Academic Article
Crystal structure of the Nipah virus phosphoprotein tetramerization domain Academic Article
Crystal structure of the TCR co-receptor CD8 alpha alpha in complex with monoclonal antibody YTS 105.18 Fab fragment at 2.88 A resolution Academic Article
Crystal structure of the TLR4-MD-2 complex with bound endotoxin antagonist Eritoran Academic Article
Crystal structure of the anti-viral apobec3g catalytic domain and functional implications Academic Article
Crystal structure of the botulinum neurotoxin type G binding domain: insight into cell surface binding Academic Article
Crystal structure of the broadly cross-reactive hiv-1-neutralizing fab x5 and fine mapping of its epitope Academic Article
Crystal structure of the chemokine receptor CXCR4 in complex with a viral chemokine Academic Article
Crystal structure of the complex of brugia malayi cyclophilin and cyclosporin a Academic Article
Crystal structure of the cysteine-rich secretory protein stecrisp reveals that the cysteine-rich domain has a k(+) channel inhibitor-like fold Academic Article
Crystal structure of the first eubacterial Mre11 nuclease reveals novel features that may discriminate substrates during DNA repair Academic Article
Crystal structure of the global regulatory protein CsrA from Pseudomonas putida at 2.05 Å resolution reveals a new fold Academic Article
Crystal structure of the gtpase domain of rat dynamin 1 Academic Article
Crystal structure of the human 4-1BB/4-1BBL complex Academic Article
Crystal structure of the human n-myc downstream-regulated gene 2 protein provides insight into its role as a tumor suppressor Academic Article
Crystal structure of the lactose operon repressor and its complexes with DNA and inducer Academic Article
Crystal structure of the membrane-bound bifunctional transglycosylase pbp1b from escherichia coli Academic Article
Crystal structure of the murine NK cell-activating receptor NKG2D at 1.95 A Academic Article
Crystal structure of the oligomeric form of Lassa virus matrix protein Z Academic Article
Crystal structure of the potent natural product inhibitor balanol in complex with the catalytic subunit of camp-dependent protein kinase Academic Article
Crystal structure of the spindle assembly checkpoint protein Bub3 Academic Article
Crystal structure of the transcriptional repressor pagr of bacillus anthracis Academic Article
Crystal structure of the von Willebrand factor A1 domain in complex with the function blocking NMC-4 Fab Academic Article
Crystal structure of the von Willebrand factor modulator botrocetin Academic Article
Crystal structure of the zorbamycin-binding protein ZbmA, the primary self-resistance element in Streptomyces flavoviridis ATCC21892 Academic Article
Crystal structure of thy1, a thymidylate synthase complementing protein from Thermotoga maritima at 2.25 Å resolution Academic Article
Crystal structure of tritrichomonas foetus inosine-5'-monophosphate dehydrogenase and the enzyme-product complex Academic Article
Crystal structure of tyrosine hydroxylase at 2.3 Å and its implications for inherited neurodegenerative diseases Academic Article
Crystal structure of tyrosine hydroxylase with bound cofactor analogue and iron at 2.3 Å resolution: Self-hydroxylation of phe300 and the pterin-binding site Academic Article
Crystal structure of uronate isomerase (TM0064) from Thermotoga maritima at 2.85 Å resolution Academic Article
Crystal structure of viral macrophage inflammatory protein i encoded by kaposi's sarcoma-associated herpesvirus at 1.7 a Academic Article
Crystal structure of virulence factor CJ0248 from Campylobacter jejuni at 2.25 Å resolution reveals a new fold Academic Article
Crystal structure of y34f mutant human mitochondrial manganese superoxide dismutase and the functional role of tyrosine 34 Academic Article
Crystal structures and biochemical analyses suggest a unique mechanism and role for human glycyl-tRNA synthetase in Ap4A homeostasis Academic Article
Crystal structures of MW1337R and lin2004: Representatives of a novel protein family that adopt a four-helical bundle fold Academic Article
Crystal structures of a quorum-quenching antibody Academic Article
Crystal structures of actin-related protein 2/3 complex with bound ATP or ADP Academic Article
Crystal structures of apo wild-type M. jannaschii tyrosyl-tRNA synthetase (TyrRS) and an engineered TyrRS specific for O-methyl-L-tyrosine Academic Article
Crystal structures of apolipoprotein(a) kringle iv37 free and complexed with 6-aminohexanoic acid and with p-aminomethylbenzoic acid: Existence of novel and expected binding modes Academic Article
Crystal structures of cytochrome p450 2b4 in complex with the inhibitor 1-biphenyl-4-methyl-1h-imidazole: Ligand-induced structural response through alpha-helical repositioning Academic Article
Crystal structures of ferredoxin variants exhibiting large changes in fe-s reduction potential Academic Article
Crystal structures of homoserine dehydrogenase suggest a novel catalytic mechanism for oxidoreductases Academic Article
Crystal structures of human GAR Tfase at low and high pH and with substrate β-GAR Academic Article
Crystal structures of human HSP90 alpha-complexed with dihydroxyphenylpyrazoles Academic Article
Crystal structures of human bifunctional enzyme aminoimidazole-4-carboxamide ribonucleotide transformylase/IMP cyclohydrolase in complex with potent sulfonyl-containing antifolates Academic Article
Crystal structures of human immunodeficiency virus type 1 (hiv-1) neutralizing antibody 2219 in complex with three different v3 peptides reveal a new binding mode for hiv-1 cross-reactivity Academic Article
Crystal structures of human topoisomerase i in covalent and noncovalent complexes with DNA Academic Article
Crystal structures of leukotriene a(4) hydrolase in complex with captopril and two competitive tight-binding inhibitors Academic Article
Crystal structures of mouse CD1d-iGb3 complex and its cognate v alpha 14 T cell receptor suggest a model for dual recognition of foreign and self glycolipids Academic Article
Crystal structures of nucleosome core particles in complex with minor groove DNA-binding ligands Academic Article
Crystal structures of protein phosphatase-1 bound to nodularin-R and tautomycin: a novel scaffold for structure-based drug design of serine/threonine phosphatase inhibitors Academic Article
Crystal structures of substrate-bound and substrate-free cytochrome P450 46A1, the principal cholesterol hydroxylase in the brain Academic Article
Crystal structures of the free and liganded form of an esterolytic catalytic antibody Academic Article
Crystal structures of the inactive D30N mutant of feline immunodeficiency virus protease complexed with a substrate and an inhibitor Academic Article
Crystal structures of the metal-dependent 2-dehydro-3-deoxy-galactarate aldolase suggest a novel reaction mechanism Academic Article
Crystal structures of the outer membrane domain of intimin and invasin from enterohemorrhagic e. Coil and enteropathogenic y. Pseudotuberculosis Academic Article
Crystal structures of three representatives of a new Pfam family PF14869 (DUF4488) suggest they function in sugar binding/uptake Academic Article
Crystal structures of transhydrogenase domain i with and without bound nadh Academic Article
Crystal structures of two I-A(d)-peptide complexes reveal that high affinity can be achieved without large anchor residues Academic Article
Crystal structures of two novel dye-decolorizing peroxidases reveal a β-barrel fold with a conserved heme-binding motif Academic Article
Crystal structures of two rat mhc class ia (rt1-a) molecules that are associated differentially with peptide transporter alleles tap-a and tap-b Academic Article
Crystal structures of two subtype n10 neuraminidase-like proteins from bat influenza a viruses reveal a diverged putative active site Academic Article
Crystal structures that suggest late development of genetic code components for differentiating aromatic side chains Academic Article
Crystal-structure and mutational analysis of human uracil-DNA glycosylase - structural basis for specificity and catalysis Academic Article
Crystal-structure of C-T-C-T-C-G-A-G-A-G - implications for the structure of the Holliday junction Academic Article
Crystal-structure of a covalent DNA drug adduct - anthramycin bound to C-C-A-A-C-G-T-T-G-G and a molecular explanation of specificity Academic Article
Crystal-structure of an h-2k(b)-ovalbumin peptide complex reveals the interplay of primary and secondary anchor positions in the major histocompatibility complex binding groove Academic Article
Crystal-structure of murine cyclophilin-c complexed with immunosuppressive drug cyclosporine-a Academic Article
Crystal-structure of peptide-n-4-(n-acetyl-beta-d-glucosaminyl)asparagine amidase-f at 2.2 Å resolution Academic Article
Crystal-structure of the cell cycle-regulatory protein suc1 reveals a beta-hinge conformational switch Academic Article
Crystal-structure of the human cell-cycle protein ckshs1 - single-domain fold with similarity to kinase n-lobe domain Academic Article
Crystal-structure of the principal neutralization site of hiv-1 Academic Article
Crystal-structures of a schistosomal drug and vaccine target - glutathione-s-transferase from schistosoma-japonica and its complex with the leading antischistosomal drug praziquantel Academic Article
Crystal-structures of aconitase with trans-aconitate and nitrocitrate bound Academic Article
Crystallization and preliminary X-ray analysis of a native human tRNA synthetase whose allelic variants are associated with Charcot-Marie-Tooth disease Academic Article
Crystallization and preliminary X-ray analysis of human carbonic anhydrase III Academic Article
Crystallization and preliminary X-ray characterization of the nitrile reductase QueF: a queuosine-biosynthesis enzyme Academic Article
Crystallization and preliminary X-ray crystallographic analysis of CheW from Thermotoga maritima: a coupling protein of CheA and the chemotaxis receptor Academic Article
Crystallization and preliminary X-ray crystallographic analysis of Escherichia coli CheA P3 dimerization domain Academic Article
Crystallization and preliminary X-ray crystallographic analysis of Thermotoga maritima CheA P3-P4-P5 domains in complex with CheW Academic Article
Crystallization and preliminary X-ray diffraction analysis of human adenovirus Academic Article
Crystallization and preliminary analysis of a dsdna bacteriophage capsid intermediate: Prohead ii of hk97 Academic Article
Crystallization and preliminary crystallographic data for class-i deoxyribose-5-phosphate aldolase from escherichia-coli - an application of reverse screening Academic Article
Crystallization and preliminary crystallographic data for rab guanine-nucleotide dissociation inhibitor (rabgdi) from bovine brain Academic Article
Crystallization and preliminary crystallographic investigations of avian 5-aminoimidazole-4-carboxamide ribonucleotide transformylase-inosine monophosphate cyclohydrolase expressed in escherichia coli Academic Article
Crystallization and preliminary structural studies of a chorismate mutase catalytic antibody complexed with a transition-state analog Academic Article
Crystallization and preliminary x-ray analysis of the dsdna bacteriophage hk97 mature empty capsid Academic Article
Crystallization and preliminary-x-ray analysis of the cytoplasmic domain of human erythrocyte band-3 Academic Article
Crystallization of HLA-DR4 fused to an immunodominant collagen ll peptide implicated in rheumatoid arthritis Academic Article
Crystallization of a carbamatase catalytic antibody fab fragment and its complex with a transition-state analogue Academic Article
Crystallization of adp-ribosyl cyclase from aplysia californica Academic Article
Crystallization optimum solubility screening: Using crystallization results to identify the optimal buffer for protein crystal formation Academic Article
Crystallizing membrane proteins using lipidic mesophases Academic Article
Crystallographic analysis of a novel complex of actinomycin D bound to the DNA decamer CGATCGATCG Academic Article
Crystallographic analysis of the dsdna bacteriophage hk97 mature empty capsid Academic Article
Crystallographic analysis of the human phenylalanine hydroxylase catalytic domain with bound catechol inhibitors at 2.0 Å resolution Academic Article
Crystallographic and biochemical analysis of cocaine-degrading antibody l5a10 Academic Article
Crystallographic and computational analyses of AUUCU repeating RNA that causes spinocerebellar ataxia type 10 (SCA10) Academic Article
Crystallographic fragment-based drug discovery: use of a brominated fragment library targeting HIV protease Academic Article
Crystallographic identification of lipid as an integral component of the epitope of HIV broadly neutralizing antibody 4E10 Academic Article
Crystallographic structure reveals phosphorylated pilin from neisseria: Phosphoserine sites modify type iv pilus surface chemistry and fibre morphology Academic Article
Crystallographic structures of Discosoma red fluorescent protein with immature and mature chromophores: Linking peptide bond trans-cis isomerization and acylimine formation in chromophore maturation Academic Article
Crystallographic studies of Xe and Kr binding within the large internal cavity of cytochrome ba3 from Thermus thermophilus: structural analysis and role of oxygen transport channels in the heme-Cu oxidases Academic Article
Crystallography of the integral membrane protein emre from escherichia coli Academic Article
Crystallohydrodynamics for solving the hydration problem for multi-domain proteins: Open physiological conformations for human IgG Academic Article
Cu,Zn superoxide dismutase structure from a microbial pathogen establishes a class with a conserved dimer interface Academic Article
Cubic crystals of chloramphenicol phosphotransferase from Streptomyces venezuelae in complex with chloramphenicol Academic Article
Cubic crystals of phosphopantetheine adenylyltransferase from Escherichia coli Academic Article
Curariform antagonists bind in different orientations to acetylcholine-binding protein Academic Article
Cyclostreptin derivatives specifically target cellular tubulin and further map the paclitaxel site Academic Article
CysG structure reveals tetrapyrrole-binding features and novel regulation of siroheme biosynthesis Academic Article
Cysteine modifiers suggest an allosteric inhibitory site on the CAL PDZ domain Academic Article
Cytochrome rc(552), formed during expression of the truncated, thermus thermophilus cytochrome c(552) gene in the cytoplasm of escherichia coli, reacts spontaneously to form protein-bound 2-formyl-4-vinyl (spirographis) heme Academic Article
Cytotoxicity of a Ti(IV) compound is independent of serum proteins Academic Article
DFT calculations of comparative energetics and ENDOR/Mossbauer properties for two protonation states of the iron dimer cluster of ribonucleotide reductase intermediate X Academic Article
DFT calculations of isomer shifts and quadrupole splitting parameters in synthetic iron-oxo complexes: applications to methane monooxygenase and ribonucleotide reductase Academic Article
DIx5 homeodomain:DNA complex: structure, binding and effect of mutations related to split hand and foot malformation syndrome Academic Article
DNA apurinic-apyrimidinic site binding and excision by endonuclease iv Academic Article
DNA binding and nucleotide flipping by the human DNA repair protein agt Academic Article
DNA binding, nucleotide flipping, and the helix-turn-helix motif in base repair by o-6-alkylguanine-DNA alkyltransferase and its implications for cancer chemotherapy Academic Article
DNA complexed structure of the key transcription factor initiating development in sporulating bacteria Academic Article
DNA packaging and delivery machines in tailed bacteriophages Academic Article
DNA recognition by a σ(54) transcriptional activator from Aquifex aeolicus Academic Article
DNA repair and global sumoylation are regulated by distinct Ubc9 noncovalent complexes Academic Article
DNA-bound structures and mutants reveal abasic DNA binding by ape1 DNA repair and coordination Academic Article
DNA-induced alpha-helix capping in conserved linker sequences is a determinant of binding affinity in Cys(2)-His(2) zinc fingers Academic Article
De novo computational design of retro-aldol enzymes Academic Article
De novo design of covalently constrained mesosize protein scaffolds with unique tertiary structures Academic Article
De novo synthesis of uronic acid building blocks for assembly of heparin oligosaccharides Academic Article
Deeply inverted electron-hole recombination in a luminescent antibody-stilbene complex Academic Article
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Density functional and electrostatics study of oxidized and reduced ribonucleotide reductase: comparisons with methane monooxygenase Academic Article
Density functional study for the bridged dinuclear center based on a high-resolution X-ray crystal structure of ba3 cytochrome c oxidase from Thermus thermophilus Academic Article
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Density functional theory calculations on Mossbauer parameters of nonheme iron nitrosyls Academic Article
Design and characterization of mechanism-based inhibitors for the tyrosine aminomutase sgtam Academic Article
Design and discovery of N-(2-Methyl-5 '-morpholino-6 '-((tetrahydro-2H-pyran-4-yl)oxy)- 3,3 '-bipyridin -5-yl)-3-(trifluoromethyl)benzamide (RAF709): a potent, selective, and efficacious RAF inhibitor targeting RAS mutant cancers Academic Article
Design and synthesis of 2-amino-isoxazolopyridines as Polo-like kinase inhibitors Academic Article
Design and synthesis of 2-amino-pyrazolopyridines as Polo-like kinase 1 inhibitors Academic Article
Design and synthesis of a biaryl series as inhibitors for the bromodomains of CBP/P300 Academic Article
Design and synthesis of c5 methylated l-arginine analogues as active site probes for nitric oxide synthase Academic Article
Design and synthesis of highly potent and isoform selective JNK3 inhibitors: SAR studies on aminopyrazole derivatives Academic Article
Design and synthesis of selenazole-containing peptides for cocrystallization with p-glycoprotein Academic Article
Design at the atomic level: design of biaryloxazolidinones as potent orally active antibiotics Academic Article
Design at the atomic level: generation of novel hybrid biaryloxazolidinones as promising new antibiotics Academic Article
Design of a redox-linked active metal site: manganese bound to bacterial reaction centers at a site resembling that of photosystem II Academic Article
Design of activated serine-containing catalytic triads with atomic-level accuracy Academic Article
Design of immunogens to elicit broadly neutralizing antibodies against HIV targeting the CD4 binding site Academic Article
Design of in vitro symmetric complexes and analysis by hybrid methods reveal mechanisms of HIV capsid assembly Academic Article
Design of potent and selective 2-aminobenzimidazole-based p38 alpha MAP kinase inhibitors with excellent in vivo efficacy Academic Article
Design, synthesis and SAR of novel glucokinase activators Academic Article
Design, synthesis and biological evaluation of novel 4-phenylisoquinolinone BET bromodomain inhibitors Academic Article
Design, synthesis and evaluation of a PLG tripeptidomimetic based on a pyridine scaffold Academic Article
Design, synthesis and structure-activity relationships of novel biarylamine-based Met kinase inhibitors Academic Article
Design, synthesis, and biological evaluation of peptidomimetic inhibitors of factor XIa as novel anticoagulants Academic Article
Design, synthesis, and pharmacological evaluation of phenoxy pyridyl derivatives as dual norepinephrine reuptake inhibitors and 5-HT1A partial agonists Academic Article
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Designing sequence to control protein function in an EF-hand protein Academic Article
Detailed analysis of the free and bound conformations of an antibody - x-ray structures of fab 17/9 and 3 different fab-peptide complexes Academic Article
Determinants for dephosphorylation of the RNA polymerase II C-terminal domain by Scp1 Academic Article
Determinants of cytochrome P4502C8 substrate binding - structures of complexes with montelukast, troglitazone, felodipine, and 9-cis-retinoic acid Academic Article
Determination of antibody structures Academic Article
Determination of structural models of the complex between the cytoplasmic domain of erythrocyte band 3 and ankyrin-R repeats 13-24 Academic Article
Determination of the NMR solution structure of the hoechst 33258-d(gtggaattccac)(2) complex and comparison with the x-ray crystal-structure Academic Article
Determination of the absolute-configuration of (+)-neopentyl-1-d alcohol by neutron and x-ray-diffraction analysis Academic Article
Development and structural analysis of a nanomolar cyclic peptide antagonist for the EphA4 receptor Academic Article
Development of 6-substituted indolylquinolinones as potent Chek1 kinase inhibitors Academic Article
Development of Toxoplasma gondii calcium-dependent protein kinase 1 (TgCDPK1) inhibitors with potent anti-toxoplasma activity Academic Article
Development of amino-pyrimidine inhibitors of c-Jun N-terminal kinase (JNK): Kinase profiling guided optimization of a 1,2,3-benzotriazole lead Academic Article
Development of covalent inhibitors that can overcome resistance to first-generation FGFR kinase inhibitors Academic Article
Development of human cGAS-specific small-molecule inhibitors for repression of dsDNA-triggered interferon expression Academic Article
Development of inhibitors of the PAS-B domain of the HIF-2α transcription factor Academic Article
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Development of thioquinazolinones, allosteric Chk1 kinase inhibitors Academic Article
Diastereoselective HOTf-catalyzed three-component one-pot 1,3-dipolar cycloaddition of α-diazo ester, nitrosobenzene and electron-deficient alkene Academic Article
Diazinones as P2 replacements for pyrazole-based cathepsin S inhibitors Academic Article
Diffraction quality crystals of protein-x from azotobacter-vinelandii Academic Article
Diflunisal analogues stabilize the native state of transthyretin. Potent inhibition of amyloidogenesis Academic Article
Dimer asymmetry defines α-catenin interactions Academic Article
Direct imaging of interactions between an icosahedral virus and conjugate f-ab fragments by cryoelectron microscopy and x-ray crystallography Academic Article
Directed evolution of an anti-prion protein scfv fragment to an affinity of 1 pm and its structural interpretation Academic Article
Directed evolution of d-sialic acid aldolase to l-3-deoxy-manno-2-octulosonic acid (l-kdo) aldolase Academic Article
Discovery and characterization of a highly selective FAAH inhibitor that reduces inflammatory pain Academic Article
Discovery and optimization of C-2 methyl imidazopyrrolopyridines as potent and orally bioavailable JAK1 inhibitors with selectivity over JAK2 Academic Article
Discovery and optimization of a series of pyrimidine-based phosphodiesterase 10A (PDE10A) inhibitors through fragment screening, structure-based design, and parallel synthesis Academic Article
Discovery of 3,5-substituted 6-azaindazoles as potent pan-Pim inhibitors Academic Article
Discovery of 5-azaindazole (GNE-955) as a potent pan-pim inhibitor with optimized bioavailability Academic Article
Discovery of 7-tetrahydropyran-2-yl chromans: β-site amyloid precursor protein cleaving enzyme 1 (BACE1) inhibitors that reduce amyloid β-protein (Aβ) in the central nervous system Academic Article
Discovery of AZ0108, an orally bioavailable phthalazinone PARP inhibitor that blocks centrosome clustering Academic Article
Discovery of C-(1-aryl-cyclohexyl)-methylamines as selective, orally available inhibitors of dipeptidyl peptidase IV Academic Article
Discovery of Potent Coumarin-Based Kinetic Stabilizers of Amyloidogenic Immunoglobulin Light Chains Using Structure-Based Design Academic Article
Discovery of a noncovalent, mutant-selective epidermal growth factor receptor inhibitor Academic Article
Discovery of a potent, selective, and orally available class I phosphatidylinositol 3-kinase (PI3K)/mammalian target of rapamycin (mTOR) kinase inhibitor (GDC-0980) for the treatment of cancer Academic Article
Discovery of a selective covalent inhibitor of lysophospholipase-like 1 (LYPLAL1) as a tool to evaluate the role of this serine hydrolase in metabolism Academic Article
Discovery of acylurea isosteres of 2-acylaminothiadiazole in the azaxanthene series of glucocorticoid receptor agonists Academic Article
Discovery of different types of inhibition between the human and Thermotoga maritima alpha-fucosidases by fuconojirimycin-based derivatives Academic Article
Discovery of fragment-derived small molecules for in vivo inhibition of ketohexokinase (KHK) Academic Article
Discovery of inhibitors of the channel-activating protease prostasin (CAP1/PRSS8) utilizing structure-based design Academic Article
Discovery of novel dihydro-9,10-ethano-anthracene carboxamides as glucocorticoid receptor modulators Academic Article
Discovery of novel oxazepine and diazepine carboxamides as two new classes of heat shock protein 90 inhibitors Academic Article
Discovery of novel pyrazolo[1,5-a]pyrimidines as potent pan-Pim inhibitors by structure- and property-based drug design Academic Article
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Discovery of potent and selective covalent inhibitors of JNK Academic Article
Discovery of potent and selective nonsteroidal indazolyl amide glucocorticoid receptor agonists Academic Article
Discovery of selective and noncovalent diaminopyrimidine-based inhibitors of epidermal growth factor receptor containing the T790M resistance mutation Academic Article
Discovery of selective and potent inhibitors of gram-positive bacterial thymidylate kinase (TMK) Academic Article
Dissection of the carbohydrate specificity of the broadly neutralizing-anti-hiv-1 antibody 2g12 Academic Article
Distributed automated docking of flexible ligands to proteins: parallel applications of AutoDock 2.4 Academic Article
Disulfide bond stabilization of the hexameric capsomer of human immunodeficiency virus Academic Article
Divergent evolution of protein conformational dynamics in dihydrofolate reductase Academic Article
Divergent sequence tunes ligand sensitivity in phospholipid-regulated hormone receptors Academic Article
Division of labor in transhydrogenase by alternating proton translocation and hydride transfer Academic Article
DoMCoSAR: A novel approach for establishing the docking mode that is consistent with the structure-activity relationship. Application to HIV-1 protease inhibitors and VEGF receptor tyrosine kinase inhibitors Academic Article
Dramatic improvement of crystal quality for low-temperature-grown rabbit muscle aldolase Academic Article
Dual binding sites for translocation catalysis by Escherichia coli glutathionylspermidine synthetase Academic Article
Dynamic kinetic asymmetric transfer hydrogenation of racemic 2,4-diaryl-2,3-dihydrobenzo[b][1,4]diazepines catalyzed by chiral phosphoric acids Academic Article
Dynamics of a flexible loop in dihydrofolate-reductase from escherichia-coli and its implication for catalysis Academic Article
EF5 is the high-affinity Mg2+ site in ALG-2 Academic Article
Early Strides in NMR Dynamics Measurements Academic Article
Ebolavirus VP35 Coats the Backbone of Double-Stranded RNA for Interferon Antagonism Academic Article
Effect of the viral protease on the dynamics of bacteriophage HK97 maturation intermediates characterized by variance analysis of cryo EM particle ensembles Academic Article
Effects of the cowpea chlorotic mottle bromovirus beta-hexamer structure on virion assembly Academic Article
Efficient access to the core of the Strychnos, Aspidosperma and Iboga alkaloids. A short synthesis of norfluorocurarine Academic Article
Efficient synthesis of 2-substituted-1,2,3-triazoles Academic Article
Efforts toward expansion of the genetic alphabet: structure and replication of unnatural base pairs Academic Article
Electron crystallography of proteins in membranes Academic Article
Electron tunneling in protein crystals Academic Article
Electron tunneling in single crystals of Pseudomonas aeruginosa azurins Academic Article
Elemental isomerism: A boron-nitrogen surrogate for a carbon-carbon double bond increases the chemical diversity of estrogen receptor ligands Academic Article
Elicitation of structure-specific antibodies by epitope scaffolds Academic Article
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Enantioselective intramolecular Friedel−Crafts-type α-arylation of aldehydes Academic Article
Enantioselective ortho-C-H cross-coupling of diarylmethylamines with organoborons Academic Article
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Endoperoxide formation by an α-ketoglutarate-dependent mononuclear non-haem iron enzyme Academic Article
Energetics of quasiequivalence: computational analysis of protein-protein interactions in icosahedral viruses Academic Article
Engineering a tRNA and aminoacyl-tRNA synthetase for the site-specific incorporation of unnatural amino acids into proteins in vivo Academic Article
Engineering protein for X-ray crystallography: the murine major histocompatibility complex class II molecule I-A(d) Academic Article
Engineering the polyproline II propensity of a class II major histocompatibility complex ligand peptide Academic Article
Enhanced local symmetry interactions globally stabilize a mutant virus capsid that maintains infectivity and capsid dynamics Academic Article
Enhanced major histocompatibility complex class i binding and immune responses through anchor modification of the non-canonical tumour-associated mucin 1-8 peptide Academic Article
Enhancement of α-helix mimicry by an α/β-peptide foldamer via incorporation of a dense ionic side-chain array Academic Article
Enterococcus faecium secreted antigen A generates muropeptides to enhance host immunity and limit bacterial pathogenesis Academic Article
Enzymatic catalysis of anti-Baldwin ring closure in polyether biosynthesis Academic Article
Enzyme structure with two catalytic sites for double-sieve selection of substrate Academic Article
Escherichia coli MutS tetramerization domain structure reveals that stable dimers but not tetramers are essential for DNA mismatch repair in vivo Academic Article
Eukaryotic class II cyclobutane pyrimidine dimer photolyase structure reveals basis for improved ultraviolet tolerance in plants Academic Article
Evaluation of adamantane hydroxamates as botulinum neurotoxin inhibitors: Synthesis, crystallography, modeling, kinetic and cellular based studies Academic Article
Evaluation of diverse α/β-backbone patterns for functional α-helix mimicry: analogues of the Bim BH3 domain Academic Article
Evaluation of molecular modeling of agonist binding in light of the crystallographic structure of an agonist-bound A₂A adenosine receptor Academic Article
Evidence for an intermediate conformational state of lacy Academic Article
Evidence for assembly-dependent folding of protein and rna in an icosahedral virus Academic Article
Evolution and mechanism from structures of an adp-ribosylating toxin and nad complex Academic Article
Evolution of amber suppressor tRNAs for efficient bacterial production of proteins containing nonnatural amino acids Academic Article
Evolution of negative cooperativity in glutathione transferase enabled preservation of enzyme function Academic Article
Evolution of shape complementarity and catalytic efficiency from a primordial antibody template Academic Article
Exon 5 encoded domain is not required for the toxic function of mutant sod1 but essential for the dismutase activity: Identification and characterization of two new sod1 mutations associated with familial amyotrophic lateral sclerosis Academic Article
Experimental determination of the absolute enantioselectivity of an anti body-catalyzed Diels-Alder reaction and theoretical explorations of the origins of stereoselectivity Academic Article
Exploiting chemical libraries, structure, and genomics in the search for kinase inhibitors Academic Article
Exploring icosahedral virus structures with VIPER Academic Article
Exploring the repeat protein universe through computational protein design Academic Article
Expression, purification, crystallization and preliminary x-ray analysis of the olfactomedin domain from the sea urchin cell-adhesion protein amassin Academic Article
Extracytoplasmic pas-like domains are common in signal transduction proteins Academic Article
Fatty acid amide hydrolase: An emerging therapeutic target in the endocannabinoid system Academic Article
FeMo cofactor of nitrogenase: a density functional study of states M(N), M(OX), M(R), and M(I) Academic Article
FeMo cofactor of nitrogenase: energetics and local interactions in the protein environment Academic Article
Femtosecond crystallography of membrane proteins in the lipidic cubic phase Academic Article
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First-in-class small molecule inhibitors of the single-strand DNA cytosine deaminase APOBEC3G Academic Article
Flavin-mediated dual oxidation controls an enzymatic Favorskii-type rearrangement Academic Article
Flexibility in the ABC transporter MsbA: Alternating access with a twist Academic Article
Flipping of alkylated DNA damage bridges base and nucleotide excision repair Academic Article
Fluoride-mediated capture of a noncovalent bound state of a reversible covalent enzyme inhibitor: X-ray crystallographic analysis of an exceptionally potent α-ketoheterocycle inhibitor of fatty acid amide hydrolase Academic Article
Fluorogenic small molecules requiring reaction with a specific protein to create a fluorescent conjugate for biological imaging: what we know and what we need to learn Academic Article
Focused evolution of HIV-1 neutralizing antibodies revealed by structures and deep sequencing Academic Article
Folate binding site of flavin-dependent thymidylate synthase Academic Article
Foldamers with heterogeneous backbones Academic Article
Folding and particle assembly are disrupted by single-point mutations near the autocatalytic cleavage site of nudaurelia capensis omega virus capsid protein Academic Article
Formation of a chloride-conducting state in the maltose ATP-binding cassette (ABC) transporter Academic Article
Formation of a repressive complex in the mammalian circadian clock is mediated by the secondary pocket of CRY1 Academic Article
Four-step synthesis of the antimalarial cardamom peroxide via an oxygen stitching strategy Academic Article
Fragment-based design of 3-aminopyridine-derived amides as potent inhibitors of human nicotinamide phosphoribosyltransferase (NAMPT) Academic Article
Fragment-based discovery of JAK-2 inhibitors Academic Article
Fragment-based identification of amides derived from trans-2-(pyridin-3-yl)cyclopropanecarboxylic acid as potent inhibitors of human nicotinamide phosphoribosyltransferase (NAMPT) Academic Article
Fragment-based screen against HIV protease Academic Article
From molecular diversity to catalysis: lessons from the immune system Academic Article
Full-length archaeal rad51 structure and mutants: Mechanisms for rad51 assembly and control by brca2 Academic Article
Functional analysis of hairpin ribozyme active site architecture Academic Article
Functional analysis of substrate and cofactor complex structures of a thymidylate synthase-complementing protein Academic Article
Functional and crystal structure analysis of active site adaptations of a potent anti-angiogenic human tRNA synthetase Academic Article
Functional and structural characterization of a thermostable acetyl esterase from Thermotoga maritima Academic Article
Functional implications of quasi-equivalence in a T=3 icosahedral animal virus established by cryo-electron microscopy and X-ray crystallography Academic Article
Functional mimicry of a protein hormone by a peptide agonist: The epo receptor complex at 2.8 Å Academic Article
Functional motifs in the (6-4) photolyase crystal structure make a comparative framework for DNA repair photolyases and clock cryptochromes Academic Article
Functional proteomic and structural insights into molecular recognition in the nitrilase family enzymes Academic Article
Fusion partner toolchest for the stabilization and crystallization of G protein-coupled receptors Academic Article
Fusion peptide of HIV-1 as a site of vulnerability to neutralizing antibody Academic Article
G domain dimerization controls dynamin's assembly-stimulated gtpase activity Academic Article
GPCR engineering yields high-resolution structural insights into beta2-adrenergic receptor function Academic Article
Galanthamine and non-competitive inhibitor binding to ACh-binding protein: evidence for a binding site on non-alpha-subunit interfaces of heteromeric neuronal nicotinic receptors Academic Article
Gating mechanisms of acid-sensing ion channels Academic Article
Generation and characterization of a chimeric rabbit/human Fab for co-crystallization of HIV-1 Rev Academic Article
Generation and structural analysis of reactive empty particles derived from an icosahedral virus Academic Article
Genetic incorporation of a metal-ion chelating amino acid into proteins as a biophysical probe Academic Article
Genetically encoded fragment-based discovery of glycopeptide ligands for carbohydrate-binding proteins Academic Article
Genome pool strategy for structural coverage of protein families Academic Article
Genomics, evolution, and crystal structure of a new family of bacterial spore kinases Academic Article
Geometric and electrostatic study of the [4Fe-4S] cluster of adenosine-5'-phosphosulfate reductase from broken symmetry density functional calculations and extended X-ray absorption fine structure spectroscopy Academic Article
Geometric considerations in virus capsid size specificity, auxiliary requirements, and buckling Academic Article
Global structural changes in hepatitis b virus capsids induced by the assembly effector hap1 Academic Article
Glucagon-like peptide-1 receptor ligand interactions: structural cross talk between ligands and the extracellular domain Academic Article
Glutathione transferase: new model for glutathione activation Academic Article
Go hybrid: EM, crystallography, and beyond Academic Article
Gpcr agonist binding revealed by modeling and crystallography Academic Article
Helix bundle quaternary structure from α/β-peptide foldamers Academic Article
Helix-stabilized cyclic peptides as selective inhibitors of steroid receptor-coactivator interactions Academic Article
Hemagglutinin homologue from h17n10 bat influenza virus exhibits divergent receptor-binding and ph-dependent fusion activities Academic Article
Hepatitis C virus E2 envelope glycoprotein core structure Academic Article
Heterocyclic peptide backbone modifications in an α-helical coiled coil Academic Article
Heterogeneity of functional groups in a metal-organic framework displays magic number ratios Academic Article
Heterologous rna encapsidated in pariacoto virus-like particles forms a dodecahedral cage similar to genomic rna in wild-type virions Academic Article
Heterosubtypic antibody recognition of the influenza virus hemagglutinin receptor binding site enhanced by avidity Academic Article
Hexagonal assembly of a restricting trim5 alpha protein Academic Article
High resolution structure of the ba3 cytochrome c oxidase from thermus thermophilus in a lipidic environment Academic Article
High-resolution crystal structure of an engineered human beta2-adrenergic G protein-coupled receptor Academic Article
High-resolution microtubule structures reveal the structural transitions in αβ-tubulin upon GTP hydrolysis Academic Article
High-resolution model of the microtubule Academic Article
High-resolution protein complexes from integrating genomic information with molecular simulation Academic Article
High-resolution solution structure of bacillus subtilis iia(glc) Academic Article
High-resolution solution structure of the retinoid X receptor DNA-binding domain Academic Article
High-resolution solution structures of oxidized and reduced Escherichia coli thioredoxin Academic Article
High-resolution structure of a protein spin-label in a solvent-exposed β-sheet and comparison with DEER spectroscopy Academic Article
High-resolution structure of a β-peptide bundle Academic Article
High-resolution structure of the soluble, respiratory-type rieske protein from thermus thermophilus: Analysis and comparison Academic Article
Highly discriminatory binding of capsid-cementing proteins in bacteriophage l Academic Article
Highly selective synthesis of heterosubstituted aromatic sulfamides Academic Article
Highly stereoselective one-pot synthesis of bicyclic isoxazolidines with five stereogenic centers by an organocatalytic process Academic Article
Hk97 maturation studied by crystallography and h/(2)h exchange reveals the structural basis for exothermic particle transitions Academic Article
Homodimerization controls the fibroblast growth factor 9 subfamily's receptor binding and heparan sulfate-dependent diffusion in the extracellular matrix Academic Article
How thiostrepton was made in the laboratory Academic Article
Human DNA ligase iii recognizes DNA ends by dynamic switching between two DNA-bound states Academic Article
Human GLP-1 receptor transmembrane domain structure in complex with allosteric modulators Academic Article
Human abh3 structure and key residues for oxidative demethylation to reverse DNA/rna damage Academic Article
Human antibody - fc receptor interactions illuminated by crystal structures Academic Article
Human carbonic anhydrase III: structural and kinetic study of catalysis and proton transfer Academic Article
Human ckshs2 atomic-structure - a role for its hexameric assembly in cell-cycle control Academic Article
Human glutathione transferase a4-4 crystal structures and mutagenesis reveal the basis of high catalytic efficiency with toxic lipid peroxidation products Academic Article
Human-murine transthyretin heterotetramers are kinetically stable and non-amyloidogenic. A lesson in the generation of transgenic models of diseases involving oligomeric proteins Academic Article
Hydrocarbon binding inside a hexameric pyrogallol 4 arene capsule Academic Article
Hydrogen-bonded capsules in polar, protic solvents Academic Article
Hydrogen/deuterium exchange reveals distinct agonist/partial agonist receptor dynamics within vitamin D receptor/retinoid X receptor heterodimer Academic Article
Hydrolytic antibodies: variations on a theme Academic Article
Hydroxylated polychlorinated biphenyls selectively bind transthyretin in blood and inhibit amyloidogenesis: rationalizing rodent PCB toxicity Academic Article
Hypoxia enhances S-nitrosylation-mediated NMDA receptor inhibition via a thiol oxygen sensor motif Academic Article
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Identification and structural characterization of heme binding in a novel dye-decolorizing peroxidase, TyrA Academic Article
Identification of 3,6-disubstituted dihydropyrones as inhibitors of human lactate dehydrogenase Academic Article
Identification of C-2 hydroxyethyl imidazopyrrolopyridines as potent JAK1 inhibitors with favorable physicochemical properties and high selectivity over JAK2 Academic Article
Identification of a chemical probe for bromo and extra C-terminal bromodomain inhibition through optimization of a fragment-derived hit Academic Article
Identification of a chemical probe for family VIII bromodomains through optimization of a fragment hit Academic Article
Identification of a new cryptochrome class: Structure, function, and evolution Academic Article
Identification of a novel drug lead that inhibits HCV infection and cell-to-cell transmission by targeting the HCV E2 glycoprotein Academic Article
Identification of amides derived from 1H-pyrazolo[3,4-b]pyridine-5-carboxylic acid as potent inhibitors of human nicotinamide phosphoribosyltransferase (NAMPT) Academic Article
Identification of critical active-site residues in the multifunctional human DNA-repair enzyme hap1 Academic Article
Identification of nicotinamide phosphoribosyltransferase (NAMPT) inhibitors with no evidence of CYP3A4 time-dependent inhibition and improved aqueous solubility Academic Article
Identification of pyrrolo[2,1-f][1,2,4] triazine-based inhibitors of Met kinase Academic Article
Identification of small molecular weight inhibitors of Src homology 2 domain-containing tyrosine phosphatase 2 (SHP-2) via in silico database screening combined with experimental assay Academic Article
Identification of substituted 2-thio-6-oxo-1,6-dihydropyrimidines as inhibitors of human lactate dehydrogenase Academic Article
Identification of unknown protein function using metabolite cocktail screening Academic Article
Identification, synthesis and SAR of amino substituted pyrido 3,2b pyrazinones as potent and selective PDE5 inhibitors Academic Article
Identifying conformational changes of the beta(2) adrenoceptor that enable accurate prediction of ligand/receptor interactions and screening for gpcr modulators Academic Article
IgG Fc domains that bind C1q but not effector Fcγ receptors delineate the importance of complement-mediated effector functions Academic Article
Illuminating solution responses of a LOV domain protein with photocoupled small-angle X-ray scattering Academic Article
Illustrating the machinery of life: Viruses Academic Article
Imaging RNA and dynamic protein segments with low-resolution virus crystallography: experimental design, data processing and implications of electron density maps Academic Article
Immune versus natural selection: Antibody aldolases with enzymic rates but broader scope Academic Article
Immunological origins of binding and catalysis in a Diels-Alderase antibody Academic Article
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Importance of single molecular determinants in the fidelity of expanded genetic codes Academic Article
Improved crystallographic structures using extensive combinatorial refinement Academic Article
Improvement of diffraction quality upon rehydration of dehydrated icosahedral Enterococcus faecalis pyruvate dehydrogenase core crystals Academic Article
Improving the diffraction of full-length human selenomethionyl metavinculin crystals by streak-seeding Academic Article
In meso crystal structure and docking simulations suggest an alternative proteoglycan binding site in the opca outer membrane adhesin Academic Article
In meso structure of the cobalamin transporter, btub, at 1.95 Å resolution Academic Article
In silico and intuitive predictions of cyp46a1 inhibition by marketed drugs with subsequent enzyme crystallization in complex with fluvoxamine Academic Article
In silico derived small molecules bind the filovirus VP35 protein and inhibit its polymerase cofactor activity Academic Article
In silico screening for Plasmodium falciparum enoyl-ACP reductase inhibitors Academic Article
In situ x-ray analysis of protein crystals in low-birefringent and x-ray transmissive plastic microchannels Academic Article
In vitro and in vivo studies of the trypanocidal properties of WRR-483 against Trypanosoma cruzi Academic Article
In vivo molecular evolution reveals biophysical origins of organismal fitness Academic Article
In vivo selection for the directed evolution of l-rhamnulose aldolase from l-rhamnulose-1-phosphate aldolase (rhad) Academic Article
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Inactivation of 4-oxalocrotonate tautomerase by 5-Halo-2-hydroxy-2,4-pentadienoates Academic Article
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Investigation of the binding pocket of human hematopoietic prostaglandin (PG) D2 synthase (hH-PGDS): A tale of two waters Academic Article
Investigation of the mechanism of resistance to third-generation cephalosporins by class C beta-lactamases by using chemical complementation Academic Article
Investigation of the pyrazinones as PDE5 inhibitors: evaluation of regioisomeric projections into the solvent region Academic Article
Involvement of an active-site Zn2+ ligand mechanism of human glyoxalase I Academic Article
Iodine(V) reagents in organic synthesis. Part 2. Access to complex molecular architectures via Dess-Martin periodinane-generated o-imidoquinones Academic Article
Iridium-catalyzed enantioselective allylic substitution of unstabilized enolates derived from α,β-unsaturated ketones Academic Article
Iron-catalyzed Suzuki-Miyaura coupling of alkyl halides Academic Article
Iron-sulfur cluster n5 is coordinated by an hxxxcxxcxxxxxc motif in the nuog subunit of escherichia coli nadh : Quinone oxidoreductase (complex i) Academic Article
Isolation, structure elucidation, and antitumor activity of spirohexenolides A and B Academic Article
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Isothiazolidinone inhibitors of PTP1B containing imidazoles and imidazolines Academic Article
Joint X-ray and NMR refinement of the yeast L30e-mRNA complex Academic Article
KDM2B recruitment of the polycomb group complex, PRC1.1, requires cooperation between PCGF1 and BCORL1 Academic Article
KdgF, the missing link in the microbial metabolism of uronate sugars from pectin and alginate Academic Article
Key analogs of the tetrapeptide subunit of RA-VII and deoxybouvardin Academic Article
Key analogues of the tetrapeptide subunit of RA-VII and deoxybouvardin Academic Article
Kinesin spindle protein (KSP) inhibitors. Part 8: Design and synthesis of 1,4-diaryl-4,5-dihydropyrazoles as potent inhibitors of the mitotic kinesin KSP Academic Article
Kinetic analysis of product inhibition in human manganese superoxide dismutase Academic Article
Kinetic and structural characterization of a cis-3-Chloroacrylic acid dehalogenase homologue in Pseudomonas sp UW4: A potential step between subgroups in the tautomerase superfamily Academic Article
Kinetic stabilization of an oligomeric protein by a single ligand binding event Academic Article
Kinetic stabilization of the native state by protein engineering: Implications for inhibition of transthyretin amyloidogenesis Academic Article
Kinetic, crystallographic, and mechanistic characterization of TomN: elucidation of a function for a 4-oxalocrotonate tautomerase homologue in the tomaymycin biosynthetic pathway Academic Article
Kinetics and thermodynamics of hexameric capsule formation Academic Article
L-a virus at 3.4 Å resolution reveals particle architecture and mrna decapping mechanism Academic Article
Laetirobin from the parasitic growth of Laetiporus sulphureus on Robinia pseudoacacia Academic Article
Lead optimization and modulation of hERG activity in a series of aminooxazoline xanthene β-site amyloid precursor protein cleaving enzyme (BACE1) inhibitors Academic Article
Lead optimization of a 4-aminopyridine benzamide scaffold to identify potent, selective, and orally bioavailable TYK2 inhibitors Academic Article
Lennard-Jones potential and dummy atom settings to overcome the AUTODOCK limitation in treating flexible ring systems Academic Article
Lessons in molecular recognition. 2. Assessing and improving cross-docking accuracy Academic Article
Lessons in molecular recognition: The effects of ligand and protein flexibility on molecular docking accuracy Academic Article
Ligand-induced stabilization of PPARgamma monitored by NMR spectroscopy: implications for nuclear receptor activation Academic Article
Ligands in crystal structures that aid in functional characterization Academic Article
Ligands in psi structures Academic Article
Light activation of the LOV protein Vivid generates a rapidly exchanging dimer Academic Article
Light-induced subunit dissociation by a light-oxygen-voltage domain photoreceptor from Rhodobacter sphaeroides Academic Article
Lipid binding promotes oligomerization and focal adhesion activity of vinculin Academic Article
Lipid-protein interactions in dhpc micelles containing the integral membrane protein ompx investigated by NMR spectroscopy Academic Article
Lipidic cubic phase technologies for membrane protein structural studies Academic Article
Lipopolysaccharide stabilizes the crystal packing of the abc transporter msba Academic Article
Localized reconstruction in Scipion expedites the analysis of symmetry mismatches in cryo-EM data Academic Article
Long-range structural effects of a Charcot-Marie-Tooth disease-causing mutation in human glycyl-tRNA synthetase Academic Article
Loop-loop interactions regulate KaiA-stimulated KaiC phosphorylation in the cyanobacterial KaiABC circadian clock Academic Article
Lower rim mono-functionalization of resorcinarenes Academic Article
Lysine-specific demethylase 1-selective inactivators: protein-targeted drug delivery mechanism Academic Article
MAD phasing with krypton Academic Article
MAIT recognition of a stimulatory bacterial antigen bound to MR1 Academic Article
MHC restriction: slip-sliding away Academic Article
MPD and DNA bending in crystals and in solution Academic Article
Macromolecular structure determination by electron microscopy: New advances and recent results Academic Article
Major antigen-induced domain rearrangements in an antibody Academic Article
Major antigenic site B of human influenza H3N2 viruses has an evolving local fitness landscape Academic Article
Malachite green mediates homodimerization of antibody VL domains to form a fluorescent ternary complex with singular symmetric interfaces Academic Article
Mammalian microsomal cytochrome P450 monooxygenase: structural adaptations for membrane binding and functional diversity Academic Article
Marburg virus VP35 can both fully coat the backbone and cap the ends of dsRNA for interferon antagonism Academic Article
Mechanism and energetics of green fluorescent protein chromophore synthesis revealed by trapped intermediate structures Academic Article
Mechanism and in vitro pharmacology of TAK1 inhibition by (5Z)-7-Oxozeaenol Academic Article
Mechanism of MEK inhibition determines efficacy in mutant KRAS- versus BRAF-driven cancers Academic Article
Mechanism of aldolase control of sorting nexin 9 function in endocytosis Academic Article
Mechanism-based post-translational modification and inactivation in terpene synthases Academic Article
Mechanism-based tuning of a LOV domain photoreceptor Academic Article
Mechanistic insights into the vanadium-catalyzed Achmatowicz rearrangement of furfurol Academic Article
Membrane protein crystallization in lipidic mesophases. A mechanism study using x-ray microdiffraction Academic Article
Metal directed assembly of ditopic containers and their complexes with alkylammonium salts Academic Article
Metal substitution in the active site of nitrogenase MFe7S9 (M = Mo(4+), V(3+), Fe(3+)) Academic Article
Metal-switching and self-inclusion of functional cavitands Academic Article
Microsomal cytochrome P450 2C5: comparison to microbial P450s and unique features Academic Article
Model building and refinement of a natively glycosylated HIV-1 Env protein by high-resolution cryoelectron microscopy Academic Article
Model structure of human APOBEC3G Academic Article
Modeling the evolution of drug resistance in malaria Academic Article
Models of the serine-protease domain of the human antithrombotic plasma factor-activated protein-C and its zymogen Academic Article
Modification of porous protein crystals in development of biohybrid materials Academic Article
Modulating catalytic activity by unnatural amino acid residues in a GSH-binding loop of GST P1-1 Academic Article
Modulation of alpha-thrombin function by distinct interactions with platelet glycoprotein Ib-alpha Academic Article
Modulation of cofilin phosphorylation by inhibition of the Lim family kinases Academic Article
Modulation of substrate specificities of D-sialic acid aldolase through single mutations of Val-251 Academic Article
Molecular architecture of the 26S proteasome holocomplex determined by an integrative approach Academic Article
Molecular basis for recognition of methylated and specific DNA sequences by the zinc finger protein kaiso Academic Article
Molecular basis for the recognition of a nonclassical nuclear localization signal by importin beta Academic Article
Molecular basis of interactions of cholinesterases with tight binding inhibitors Academic Article
Molecular basis of substrate promiscuity for the SAM-dependent O-methyltransferase NcsB1, involved in the biosynthesis of the enediyne antitumor antibiotic neocarzinostatin Academic Article
Molecular control of delta-opioid receptor signalling Academic Article
Molecular docking programs successfully predict the binding of a beta-lactamase inhibitory protein to TEM-1 beta-lactamase Academic Article
Molecular evolution of affinity and flexibility in the immune system Academic Article
Molecular insights into gamma delta T cell costimulation by an anti-JAML antibody Academic Article
Molecular mechanism of lipopeptide presentation by cd1a Academic Article
Molecular mimicry of SUMO promotes DNA repair Academic Article
Molecular mimicry regulates ABA signaling by SnRK2 kinases and PP2C phosphatases Academic Article
Molecular modeling and crystal structure of ERK2-hypothemycin complexes Academic Article
Molecular packing in virus crystals: Geometry, chemistry, and biology Academic Article
Molecular simulations illuminate the role of regulatory components of the RNA polymerase from the hepatitis C virus in influencing protein structure and dynamics Academic Article
Molecular-basis of cross-reactivity and the limits of antibody-antigen complementarity Academic Article
Mono-oxidation of bidentate bis-phosphines in catalyst activation: kinetic and mechanistic studies of a Pd/xantphos-catalyzed C-H functionalization Academic Article
Monoclonal-antibodies against progesterone - effect of steroid-carrier coupling position on antibody specificity Academic Article
Moving targets: Recognition of alkyl groups Academic Article
Mre11 dimers coordinate DNA end bridging and nuclease processing in double-strand-break repair Academic Article
Multi-disciplinary studies of viruses: The role of structure in shaping the questions and answers Academic Article
Multidonor analysis reveals structural elements, genetic determinants, and maturation pathway for HIV-1 neutralization by VRC01-class antibodies Academic Article
Multiple replacements of glutamine 143 in human manganese superoxide dismutase: Effects on structure, stability, and catalysis Academic Article
Multisite promiscuity in the processing of endogenous substrates by human carboxylesterase 1 Academic Article
Multivalent microtubule recognition by tubulin tyrosine ligase-like family glutamylases Academic Article
MutY catalytic core, mutant and bound adenine structures define specificity for DNA repair enzyme superfamily Academic Article
Mutational analysis of sulfite reductase hemoprotein reveals the mechanism for coordinated electron and proton transfer Academic Article
Mutational, structural, and kinetic evidence for a dissociative mechanism in the GDP-mannose mannosyl hydrolase reaction Academic Article
Mutations in GDI1 are responsible for X-linked non-specific mental retardation Academic Article
Myotonic dystrophy type 1 RNA crystal structures reveal heterogeneous 1 x 1 nucleotide UU internal loop conformations Academic Article
Myristoylome Profiling Reveals a Concerted Mechanism of ARF GTPase Deacylation by the Bacterial Protease IpaJ Academic Article
N-acylthiadiazolines, a new class of liver x receptor agonists with selectivity for lxr beta Academic Article
N-terminal domain swapping and metal ion binding in nitric oxide synthase dimerization Academic Article
N1-Alkyl pyrimidinediones as non-nucleoside inhibitors of HIV-1 reverse transcriptase Academic Article
N1-Heterocyclic pyrimidinediones as non-nucleoside inhibitors of HIV-1 reverse transcriptase Academic Article
NF kappa B selectivity of estrogen receptor ligands revealed by comparative crystallographic analyses Academic Article
NMR solution structure of the isolated Apo Pin1 WW domain: comparison to the X-ray crystal structures of Pin1 Academic Article
NMR structure of a cyclic polyamide-DNA complex Academic Article
NMR structure of the protein NP_247299.1: comparison with the crystal structure Academic Article
Native hepatitis B virions and capsids visualized by electron cryomicroscopy Academic Article
Nbs1 flexibly tethers Ctp1 and Mre11-Rad50 to coordinate DNA double-strand break processing and repair Academic Article
Near-atomic resolution reconstructions using a mid-range electron microscope operated at 200 kV Academic Article
New amphiphiles for membrane protein structural biology Academic Article
New crystal structures of human glutathione transferase A1-1 shed light on glutathione binding and the conformation of the C-terminal helix Academic Article
New hypotheses about the structure-function of proprotein convertase subtilisin/kexin type 9: analysis of the epidermal growth factor-like repeat A docking site using WaterMap Academic Article
New insights into inhibitor design from the crystal structure and NMR studies of escherichia coli GAR and 10-formyl-5,8,10-trideazafolic acid Academic Article
New supramolecular organization for a glycoluril: Chiral hydrogen-bonded ribbons Academic Article
New uses for the burgess reagent in chemical synthesis: Methods for the facile and stereoselective formation of sulfamidates, glycosylamines, and sulfamides Academic Article
Nickel superoxide dismutase structure and mechanism Academic Article
Nitric-oxide synthase forms N-NO-pterin and S-NO-cys: implications for activity, allostery, and regulation Academic Article
Nitrosyl-heme structures of Bacillus subtilis nitric oxide synthase have implications for understanding substrate oxidation Academic Article
Nmr screening and crystal quality of bacterially expressed prokaryotic and eukaryotic proteins in a structural genomics pipeline Academic Article
Nmr solution structure of alpha-conotoxin imi and comparison to other conotoxins specific for neuronal nicotinic acetylcholine receptors Academic Article
Nmr structure determination of the conserved hypothetical protein tm1816 from thermotoga maritima Academic Article
Non-charged thiamine analogs as inhibitors of enzyme transketolase Academic Article
Novel DNA-binding motifs in the DNA-repair enzyme endonuclease-iii crystal-structure Academic Article
Novel approaches for targeting the adenosine A2A receptor Academic Article
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Novel heterocyclic DPP-4 inhibitors for the treatment of type 2 diabetes Academic Article
Novel indole-3-sulfonamides as potent HIV non-nucleoside reverse transcriptase inhibitors (NNRTIs) Academic Article
Novel mechanism of hemin capture by Hbp2, the hemoglobin-binding hemophore from Listeria monocytogenes Academic Article
Novel modifications on C-terminal domain of RNA polymerase II can fine-tune the phosphatase activity of Ssu72 Academic Article
Novel triazolo-pyrrolopyridines as inhibitors of Janus kinase 1 Academic Article
Novel tricyclic inhibitors of IκB kinase Academic Article
Novel vinculin binding site of the IpaA invasin of Shigella Academic Article
Nuclear protein import is decreased by engineered mutants of nuclear transport factor 2 (ntf2) that do not bind gdp-ran Academic Article
Nucleophilic substitution by grignard reagents on sulfur mustards Academic Article
Nucleosomes in solution exist as a mixture of twist-defect states Academic Article
Nucleotide binding by the histidine kinase CheA Academic Article
Observation of an arsenic adduct in an acetyl esterase crystal structure Academic Article
Observation of covalent intermediates in an enzyme mechanism at atomic resolution Academic Article
On the solution structure of the t4 sliding clamp (gp45) Academic Article
On the stability of parainfluenza virus 5 F proteins Academic Article
On the use of DXMS to produce more crystallizable proteins: Structures of the T. Maritima proteins TM0160 and TM1171 Academic Article
On-chip synthesis and screening of a sialoside library yields a high affinity ligand for Siglec-7 Academic Article
One-pot enantioselective syntheses of iminosugar derivatives using organocatalytic anti-michael-anti-aza-henry reactions Academic Article
Open and closed conformations of two SpoiiAA-like proteins (YP_749275.1 and YP_001095227.1) provide insights into membrane association and ligand binding Academic Article
Optimization of 5-(2,6-dichlorophenyl)-3-hydroxy-2-mercaptocyclohex-2-enones as potent inhibitors of human lactate dehydrogenase Academic Article
Optimization of a pyrazoloquinolinone class of Chk1 kinase inhibitors Academic Article
Optimization of benzodiazepinones as selective inhibitors of the X-linked inhibitor of apoptosis protein (XIAP) second baculovirus IAP repeat (BIR2) domain Academic Article
Organization of the influenza virus replication machinery Academic Article
Organocatalytic asymmetric assembly reactions for the syntheses of carbohydrate derivatives by intermolecular michael-henry reactions Academic Article
Organocatalytic asymmetric domino knoevenagel/diels-alder reactions: A bioorganic approach to the diastereospecific and enantioselective construction of highly substituted spiro 5,5 undecane-1,5,9-triones Academic Article
Orientation and structure of the Ndc80 complex on the microtubule lattice Academic Article
Origins of enhanced proton transport in the Y7F mutant of human carbonic anhydrase II Academic Article
Origins of initiation rate differences in ruthenium olefin metathesis catalysts containing chelating benzylidenes Academic Article
Origins of regioselectivity of Diels-Alder reactions for the synthesis of bisanthraquinone antibiotic BE-43472B Academic Article
Origins of selectivity in pericyclic reaction cascades for the synthesis of gambogin and lateriflorone Academic Article
Origins of structural flexibility in protein-based supramolecular polymers revealed by DEER spectroscopy Academic Article
Outer domain of HIV-1 gp120: antigenic optimization, structural malleability, and crystal structure with antibody VRC-PG04 Academic Article
Overexpression, crystallization and preliminary x-ray crystallographic analysis of the variable lymphocyte receptor 2913 ectodomain fused with internalin b Academic Article
Oxidative cyclizations in orthosomycin biosynthesis expand the known chemistry of an oxygenase superfamily Academic Article
Oxidized and reduced azotobacter vinelandii ferredoxin i at 1.4 Å resolution: Conformational change of surface residues without significant change in the 3fe-4s (+/0) cluster Academic Article
Oxime side-chain cross-links in an α-helical coiled-coil protein: structure, thermodynamics, and folding-templated synthesis of bicyclic species Academic Article
P450cam visits an open conformation in the absence of substrate Academic Article
Palladium(II)-catalyzed C-H activation/C-C cross-coupling reactions: versatility and practicality Academic Article
Pd(II)-catalyzed enantioselective C-H olefination of diphenylacetic acids Academic Article
Pd-catalyzed enantioselective C-H iodination: asymmetric synthesis of chiral diarylmethylamines Academic Article
Pd-catalyzed stereoselective oxidation of methyl groups by inexpensive oxidants under mild conditions: A dual role for carboxylic anhydrides in catalytic C-H bond oxidation Academic Article
Peering down the barrel of a bacteriophage portal: the genome packaging and release valve in P22 Academic Article
Peptoid macrocycles: making the rounds with peptidomimetic oligomers Academic Article
Periodic table of virus capsids: implications for natural selection and design. Academic Article
Pharmacophore reassignment for induction of the immunosurveillance cytokine TRAIL Academic Article
Phosphatase activity of small C-terminal domain phosphatase 1 (SCP1) controls the stability of the key neuronal regulator RE1-silencing transcription factor (REST) Academic Article
Phospshoinositide 3-kinase (PI3K)/mammalian target of rapamycin (mTOR) dual inhibitors: discovery and structure-activity relationships of a series of quinoline and quinoxaline derivatives Academic Article
Photochemical control of reversible encapsulation Academic Article
Phototriggering electron flow through Re(I)-modified Pseudomonas aeruginosa azurins Academic Article
Picometer-scale conformational heterogeneity separates functional from nonfunctional states of a photoreceptor protein Academic Article
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Planarity and constraint of the carbonyl groups in 1,2-diones are determinants for selective inhibition of human carboxylesterase 1 Academic Article
Plant UVR8 photoreceptor senses UV-B by tryptophan-mediated disruption of cross-dimer salt bridges Academic Article
Plasticity of cytochrome P450 2B4 as investigated by hydrogen-deuterium exchange mass spectrometry and X-ray crystallography Academic Article
Platinum-induced space-group transformation in crystals of the platelet glycoprotein Ib alpha N-terminal domain Academic Article
Pnictogen-directed synthesis of discrete disulfide macrocycles Academic Article
Porphyrin-substituted H-NOX proteins as high-relaxivity MRI contrast agents Academic Article
Positional linker effects in haptens for cocaine immunopharmacotherapy Academic Article
Positional recognition of a tRNA determinant dependent on a peptide insertion Academic Article
Potent benzimidazole sulfonamide protein tyrosine phosphatase 1B inhibitors containing the heterocyclic (S)-isothiazolidinone phosphotyrosine mimetic Academic Article
Potent mechanism-based inactivation of cytochrome p450 2b4 by 9-ethynylphenanthrene: Implications for allosteric modulation of cytochrome p450 catalysis Academic Article
Predicting the emergence of antibiotic resistance by directed evolution and structural analysis Academic Article
Prediction of the folding pathways and structure of the GCN4 leucine zipper. Academic Article
Prediction of the tissue-specificity of selective estrogen receptor modulators by using a single biochemical method Academic Article
Preferential recognition of avian-like receptors in human influenza A H7N9 viruses Academic Article
Preliminary X-ray characterization of authentic providence virus and attempts to express its coat protein gene in recombinant baculovirus Academic Article
Preliminary crystallographic analysis of the bacteriophage p22 portal protein Academic Article
Preliminary x-ray diffraction studies of the transcriptional inhibitory antibody fab41.4 Academic Article
Preparation of stilbene-tethered nonnatural nucleosides for use with blue-fluorescent antibodies Academic Article
Principles of quasi-equivalence and Euclidean geometry govern the assembly of cubic and dodecahedral cores of pyruvate dehydrogenase complexes Academic Article
Probing the anti body-catalyzed water-oxidation pathway at atomic resolution Academic Article
Probing the catalytic mechanism of sulfite reductase by X-ray crystallography: Structures of the escherichia coli hemoprotein in complex with substrates, inhibitors, intermediates, and products Academic Article
Production of a human neutralizing monoclonal antibody and its crystal structure in complex with ectodomain 3 of the interleukin-13 receptor alpha 1 Academic Article
Production, characterization, and assessment of a stable analog of the response regulator CheY-phosphate from Thermotoga maritima Academic Article
Proof of principle for epitope-focused vaccine design Academic Article
Proteasome activity imaging and profiling characterizes bacterial effector syringolin A Academic Article
Protein S-thiolation by Glutathionylspermidine (Gsp): the role of Escherichia coli Gsp synthetASE/amidase in redox regulation Academic Article
Protein arginine deiminase 2 binds calcium in an ordered fashion: implications for inhibitor design Academic Article
Protein biophysical properties that correlate with crystallization success in thermotoga maritima: Maximum clustering strategy for structural genomics Academic Article
Protein conformer selection by ligand binding observed with crystallography Academic Article
Protein engineering for crystallization of the GTPase Sar1 that regulates ER vesicle budding Academic Article
Protein flexibility in virtual screening: the BACE-1 case study Academic Article
Protein mimicry of DNA from crystal structures of the uracil-DNA glycosylase inhibitor protein and its complex with escherichia coli uracil-DNA glycosylase Academic Article
Protein-like tertiary folding behavior from heterogeneous backbones Academic Article
Protein-rna interactions and virus stability as probed by the dynamics of tryptophan side chains Academic Article
Pseudo-atomic models of swollen ccmv from cryo-electron microscopy data Academic Article
Purification and crystallization of a schistosomal glutathione-s-transferase Academic Article
Purification and preliminary crystallographic studies on the sporulation response regulatory phosphotransferase protein, spo0b, from bacillus subtilis Academic Article
Purification, characterization, assembly and crystallization of assembled alfalfa mosaic virus coat protein expressed in escherichia coli Academic Article
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Purification, partial characterization, crystallization and preliminary X-ray diffraction of two cysteine-rich secretory proteins from naja atra and trimeresurus stejnegeri venoms Academic Article
Pyridine amides as potent and selective inhibitors of 11β-hydroxysteroid dehydrogenase type 1 Academic Article
Quinone diazides for olefin functionalization Academic Article
RNA helical packing in solution: NMR structure of a 30 kDa GAAA tetraloop-receptor complex Academic Article
RNF4 interacts with both SUMO and nucleosomes to promote the DNA damage response Academic Article
Rapid development of piperidine carboxamides as potent and selective anaplastic lymphoma kinase inhibitors Academic Article
Rapid discovery and structure-activity profiling of novel inhibitors of human immunodeficiency virus type 1 protease enabled by the copper(I)-catalyzed synthesis of 1,2,3-triazoles and their further functionalization Academic Article
Rapid refinement of crystallographic protein construct definition employing enhanced hydrogen/deuterium exchange MS Academic Article
Rational HIV immunogen design to target specific germline B cell receptors Academic Article
Rational design of fatty acid amide hydrolase inhibitors that act by covalently bonding to two active site residues Academic Article
Rational design of lipid for membrane protein crystallization Academic Article
Rational design of phosphoinositide 3-kinase α inhibitors that exhibit selectivity over the phosphoinositide 3-kinase β isoform Academic Article
Rational design of potent human transthyretin amyloid disease inhibitors Academic Article
Rational design, synthesis, evaluation, and crystal structure of a potent inhibitor of human GAR Tfase: 10-(trifluoroacetyl)-5,10-dideazaacyclic-5,6,7,8-tetrahydrofolic acid Academic Article
Rational development of 4-aminopyridyl-based inhibitors targeting Trypanosoma cruzi CYP51 as anti-chagas agents Academic Article
Rational ligand design for the arylation of hindered primary amines guided by reaction progress kinetic analysis Academic Article
Reaction intermediates in the catalytic mechanism of escherichia coli muty DNA glycosylase Academic Article
Reaction mechanism of glyoxalase I explored by an X-ray crystallographic analysis of the human enzyme in complex with a transition state analogue Academic Article
Receptor rigidity and ligand mobility in trypsin-ligand complexes Academic Article
Reciprocal space representations of helical objects and their projection images for helices constructed from motifs without spherical symmetry Academic Article
Recognition of microbial glycans by human intelectin-1 Academic Article
Recognition of rna polymerase ii and transcription bubbles by xpg, csb, and tfiih: Insights for transcription-coupled repair and cockayne syndrome Academic Article
Recognition of the ring-opened state of proliferating cell nuclear antigen by replication factor c promotes eukaryotic clamp-loading Academic Article
Reconstruction of 3D structures of MET antibodies from electron microscopy 2D class averages Academic Article
Reconstruction of the chemotaxis receptor-kinase assembly Academic Article
Recurring conformation of the human immunodeficiency virus type 1 gp120 V3 loop Academic Article
Reduction of bicyclo[3.3.1]nonane-2,8-diones with baker's yeast Academic Article
Refined crystallographic structure of pseudomonas aeruginosa exotoxin a and its implications for the molecular mechanism of toxicity Academic Article
Refined structure of the nicotinic acetylcholine receptor at 4 Å resolution Academic Article
Refinement of netropsin bound to DNA - bias and feedback in electron-density map interpretation Academic Article
Regulating the ARNT/TACC3 axis: multiple approaches to manipulating protein/protein interactions with small molecules Academic Article
Regulation of A20 and other OTU deubiquitinases by reversible oxidation Academic Article
Replacement of the axial histidine ligand with imidazole in cytochrome c peroxidase. 1. Effects on structure Academic Article
Reprogramming the chemodiversity of terpenoid cyclization by remolding the active site contour of epi-isozizaene synthase Academic Article
Repulsive interaction can be a key design element of molecular rotary motors Academic Article
Reshaping antibody diversity Academic Article
Reverse actin sliding triggers strong myosin binding that moves tropomyosin Academic Article
Reversible competitive α-ketoheterocycle inhibitors of fatty acid amide hydrolase containing additional conformational constraints in the acyl side chain: orally active, long-acting analgesics Academic Article
Revised rna2 sequence of the tetravirus, nudaurelia capensis omega virus (n omega v) Academic Article
Rhodium(II)-catalyzed asymmetric sulfur(VI) reduction of diazo sulfonylamidines Academic Article
Rhodium-catalyzed asymmetric enyne cycloisomerization of terminal alkynes and formal total synthesis of (-)-platensimycin Academic Article
Rhombohedral crystals of 2-dehydro-3-deoxygalactarate aldolase from Escherichia coli Academic Article
Rhombohedral crystals of Mycobacterium tuberculosis phosphopantetheine adenylyltransferase Academic Article
Rhombohedral crystals of the human vinculin head domain in complex with a vinculin-binding site of talin Academic Article
Ribonucleocapsid formation of severe acute respiratory syndrome coronavirus through molecular action of the n-terminal domain of n protein Academic Article
Rigid body refinement of protein complexes with long-range distance restraints from pulsed dipolar ESR Academic Article
Rigid tetranitroresorcinarenes Academic Article
Ring-closing metathesis of olefinic peptides: design, synthesis, and structural characterization of macrocyclic helical peptides Academic Article
Robotics for automated crystal formation and analysis Academic Article
Role of hydrogen bonding in the active site of human manganese superoxide dismutase Academic Article
Role of tryptophan 161 in catalysis by human manganese superoxide dismutase Academic Article
Rotameric preferences of a protein spin label at edge-strand β-sheet sites Academic Article
S-Nitrosylation induces structural and dynamical changes in a rhodanese family protein Academic Article
SDOCKER: A method utilizing existing X-ray structures to improve docking accuracy Academic Article
SIRT6 regulates TNF-alpha secretion through hydrolysis of long-chain fatty acyl lysine Academic Article
SR2067 reveals a unique kinetic and structural signature for PPARγ partial agonism Academic Article
Scalable total synthesis and biological evaluation of haouamine a and its atropisomer Academic Article
Scorpion-toxin mimics of cd4 in complex with human immunodeficiency virus gp120: Crystal structures, molecular mimicry, and neutralization breadth Academic Article
Sculpting of DNA at abasic sites by DNA glycosylase homolog mag2 Academic Article
Selection of functional T cell receptor mutants from a yeast surface-display library Academic Article
Selective Detection of Caspase-3 versus Caspase-7 Using Activity-Based Probes with Key Unnatural Amino Acids Academic Article
Selective N1/N4 1,4-Cycloaddition of 1,2,4,5-Tetrazines Enabled by Solvent Hydrogen Bonding Academic Article
Selective inactivation of a human neuronal silencing phosphatase by a small molecule inhibitor Academic Article
Selective recognition and extraction of the uranyl ion Academic Article
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Sequence and structural convergence of broad and potent hiv antibodies that mimic cd4 binding Academic Article
Sequence homology and structural analysis of the clostridial neurotoxins Academic Article
Sequence recognition of DNA by lexitropsins Academic Article
Serial femtosecond crystallography of G protein-coupled receptors Academic Article
Serotype-specific structural differences in the protease-cofactor complexes of the dengue virus family Academic Article
Sesquiterpenes from the basidiomycete Omphalotus illudens Academic Article
Severe acute respiratory syndrome coronavirus papain-like protease: Structure of a viral deubiquitinating enzyme Academic Article
Shared and unique determinants of the erythropoietin (epo) receptor are important for binding epo and epo mimetic peptide Academic Article
Short total synthesis of (+/-)-sceptrin Academic Article
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Shotgun crystallization strategy for structural genomics: An optimized two-tiered crystallization screen against the Thermotoga maritima proteome Academic Article
Side chain conformational averaging in human dihydrofolate reductase Academic Article
Side chain independent recognition of aminoacyl adenylates by the Hint1 transcription suppressor Academic Article
Simultaneous refinement of the structure of bpti against NMR data measured in solution and x-ray-diffraction data measured in single-crystals Academic Article
Single particle image reconstruction of the human recombinant kv2.1 channel Academic Article
Single-component multilayered self-assembling nanoparticles presenting rationally designed glycoprotein trimers as Ebola virus vaccines Academic Article
Site-directed mutagenesis azotobacter-vinelandii ferredoxin-i - cysteine ligation of the 4fe-4s cluster with protein rearrangement is preferred over serine ligation Academic Article
Site-specific protein modification through Cu-I-catalyzed 1,2,3-triazole formation and its implementation in protein microarray fabrication Academic Article
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Small molecule modulation of nuclear receptor conformational dynamics: implications for function and drug discovery Academic Article
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Solvent isotope effects on interfacial protein electron transfer in crystals and electrode films Academic Article
Specific recognition of a DNA immunogen by its elicited antibody Academic Article
Spin coupling in Roussin's red and black salts Academic Article
Spin labeling monitors weak host-guest interactions Academic Article
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Stapled HIV-1 peptides recapitulate antigenic structures and engage broadly neutralizing antibodies Academic Article
Status of gpcr modeling and docking as reflected by community-wide gpcr dock 2010 assessment Academic Article
Stereoselective 1,3-insertions of rhodium(II) azavinyl carbenes Academic Article
Stereoselective synthesis and osteogenic activity of subglutinols A and B Academic Article
Steric and conformational features of the aconitase mechanism Academic Article
Steroid receptor coactivator peptidomimetics Academic Article
Steroid-based facial amphiphiles for stabilization and crystallization of membrane proteins Academic Article
Stilbene vinyl sulfonamides as fluorogenic sensors of and traceless covalent kinetic stabilizers of transthyretin that prevent amyloidogenesis Academic Article
Streptococcal m1 protein constructs a pathological host fibrinogen network Academic Article
Stressing-out DNA? The contribution of serine-phosphodiester interactions in catalysis by uracil DNA glycosylase Academic Article
Structural adaptations in a membrane enzyme that terminates endocannabinoid signaling Academic Article
Structural analyses reveal phosphatidyl inositols as ligands for the NR5 orphan receptors SF-1 and LRH-1 Academic Article
Structural analysis of a glutathione transferase A1-1 mutant tailored for high catalytic efficiency with toxic alkenals Academic Article
Structural analysis of arabinose-5-phosphate isomerase from Bacteroides fragilis and functional implications Academic Article
Structural analysis of caspase-1 inhibitors derived from Tethering Academic Article
Structural analysis of divalent metals binding to the bacillus subtilis response regulator spo0f: The possibility for in vitro metalloregulation in the initiation of sporulation Academic Article
Structural analysis of flexible proteins in solution by small angle x-ray scattering combined with crystallography Academic Article
Structural analysis of human alpha-class glutathione transferase A1-1 in the apo-form and in complexes with ethacrynic acid and its glutathione conjugate Academic Article
Structural analysis of inhibitor binding to human carbonic anhydrase II Academic Article
Structural analysis of mammalian cytochrome P450 2B4 covalently bound to the mechanism-based inactivator tert-butylphenylacetylene: insight into partial enzymatic activity Academic Article
Structural analysis of the alpha-2,3-sialyltransferase Cst-I from Campylobacter jejuni in apo and substrate-analogue bound forms Academic Article
Structural analysis of the quaking homodimerization interface Academic Article
Structural and biochemical characterization of the therapeutic anabaena variabilis phenylalanine ammonia lyase Academic Article
Structural and biological mimicry of protein surface recognition by α/β-peptide foldamers Academic Article
Structural and biophysical characterization of Bacillus thuringiensis insecticidal proteins Cry34Ab1 and Cry35Ab1 Academic Article
Structural and biophysical correlation of anti-NANP antibodies with in vivo protection against P. falciparum Academic Article
Structural and chemical requirements for histidine phosphorylation by the chemotaxis kinase CheA Academic Article
Structural and dynamic independence of isopeptide-linked RanGAP1 and SUMO-1 Academic Article
Structural and evolutionary relationships of "AT-less" type I polyketide synthase ketosynthases Academic Article
Structural and functional analysis of an essential nucleoporin heterotrimer on the cytoplasmic face of the nuclear pore complex Academic Article
Structural and functional analysis of the globular head domain of p115 provides insight into membrane tethering Academic Article
Structural and functional analysis of the interaction between the nucleoporin Nup214 and the DEAD-box helicase Ddx19 Academic Article
Structural and functional characterization of BaiA, an enzyme involved in secondary bile acid synthesis in human gut microbe Academic Article
Structural and functional characterization of a triple mutant form of S100A7 defective for Jab1 binding Academic Article
Structural and functional characterization of disulfide isoforms of the human IgG2 subclass Academic Article
Structural and functional characterizations of SsgB, a conserved activator of developmental cell division in morphologically complex actinomycetes Academic Article
Structural and functional studies of trans-encoded HLA-DQ2.3 (DQA1*03:01/DQB1*02:01) protein molecule Academic Article
Structural and kinetic analysis of substrate binding to the sialyltransferase Cst-II from Campylobacter jejuni Academic Article
Structural and kinetic characterization of active-site histidine as a proton shuttle in catalysis by human carbonic anhydrase II Academic Article
Structural and kinetic evidence for strain in biological catalysis Academic Article
Structural and mechanistic bases for a potent HIV-1 capsid inhibitor Academic Article
Structural and molecular characterization of iron-sensing hemerythrin-like domain within F-box and leucine-rich repeat protein 5 (FBXL5) Academic Article
Structural and thermodynamic analyses of alpha-L-fucosidase inhibitors Academic Article
Structural and thermodynamic correlates of t cell signaling Academic Article
Structural basis and biological consequences for JNK2/3 isoform selective aminopyrazoles Academic Article
Structural basis for CD1d presentation of a sulfatide derived from myelin and its implications for autoimmunity Academic Article
Structural basis for Marburg virus neutralization by a cross-reactive human antibody Academic Article
Structural basis for a disfavored elimination reaction in catalytic antibody 1D4 Academic Article
Structural basis for a switch in receptor binding specificity of two H5N1 hemagglutinin mutants Academic Article
Structural basis for allosteric regulation of GPCRs by sodium ions Academic Article
Structural basis for amide hydrolysis catalyzed by the 43C9 antibody Academic Article
Structural basis for amplifying vinculin activation by talin Academic Article
Structural basis for antibody catalysis of a cationic cyclization reaction Academic Article
Structural basis for antibody catalysis of a disfavored ring closure reaction Academic Article
Structural basis for apelin control of the human apelin receptor Academic Article
Structural basis for bifunctional peptide recognition at human delta-opioid receptor Academic Article
Structural basis for broad and potent neutralization of HIV-1 by antibody VRC01 Academic Article
Structural basis for chloramphenicol tolerance in Streptomyces venezuelae by chloramphenicol phosphotransferase activity Academic Article
Structural basis for cooperative interactions of substituted 2-aminopyrimidines with the acetylcholine binding protein Academic Article
Structural basis for disassembly of katanin heterododecamers Academic Article
Structural basis for diverse N-glycan recognition by HIV-1-neutralizing V1-V2-directed antibody PG16 Academic Article
Structural basis for double-stranded RNA processing by Dicer Academic Article
Structural basis for drug and substrate specificity exhibited by FIV encoding a chimeric FIV/HIV protease Academic Article
Structural basis for endothelial nitric oxide synthase binding to calmodulin Academic Article
Structural basis for featuring of steroid isomerase activity in alpha class glutathione transferases Academic Article
Structural basis for full-spectrum inhibition of translational functions on a tRNA synthetase Academic Article
Structural basis for high-affinity peptide inhibition of human Pin1 Academic Article
Structural basis for inhibition of protein-tyrosine phosphatase 1B by isothiazolidinone heterocyclic phosphonate mimetics Academic Article
Structural basis for ligand recognition and discrimination of a quorum-quenching antibody Academic Article
Structural basis for microRNA targeting Academic Article
Structural basis for mobility in the 1.1 Å crystal structure of the ng domain of thermus aquaticus ffh Academic Article
Structural basis for molecular recognition at serotonin receptors Academic Article
Structural basis for recognition and catalysis by the bifunctional dctp deaminase and dutpase from methanococcus jannaschii Academic Article
Structural basis for specific inhibition of tRNA synthetase by an ATP competitive inhibitor Academic Article
Structural basis for substrate targeting and catalysis by fungal polysaccharide monooxygenases Academic Article
Structural basis for synthesis of inflammatory mediators by human leukotriene C4 synthase Academic Article
Structural basis for the activation of IKK1/α Academic Article
Structural basis for the binding of an anti-cytochrome c antibody to its antigen: Crystal structures of FabE8 cytochrome c complex to 1.8 Å resolution and FabE8 to 2.26 Å resolution Academic Article
Structural basis for the coevolution of a viral RNA-protein complex Academic Article
Structural basis for the recognition of para-benzoyl-L-phenylalanine by evolved aminoacyl-tRNA synthetases Academic Article
Structural basis for the root effect in haemoglobin Academic Article
Structural basis for three-step sequential catalysis by the cholesterol side chain cleavage enzyme cyp11a1 Academic Article
Structural basis of 2C TCR allorecognition of H-2L(d) peptide complexes Academic Article
Structural basis of IMP3 RRM12 recognition of RNA Academic Article
Structural basis of JAZ repression of MYC transcription factors in jasmonate signalling Academic Article
Structural basis of PIP2 activation of the classical inward rectifier K+ channel Kir2.2 Academic Article
Structural basis of Rho GTPase-mediated activation of the formin rndia1 Academic Article
Structural basis of a shared antibody response to SARS-CoV-2 Academic Article
Structural basis of actin filament nucleation and processive capping by a formin homology 2 domain Academic Article
Structural basis of alpha-fucosidase inhibition by iminocyclitols with K(i) values in the micro- to picomolar range Academic Article
Structural basis of autoregulation of phenylalanine hydroxylase Academic Article
Structural basis of cell surface receptor recognition by botulinum neurotoxin B Academic Article
Structural basis of chaperone-subunit complex recognition by the type 1 pilus assembly platform fimd Academic Article
Structural basis of drug binding to cyp46a1, an enzyme that controls cholesterol turnover in the brain Academic Article
Structural basis of guanine nucleotide exchange mediated by the t-cell essential vav1 Academic Article
Structural basis of immune evasion at the site of cd4 attachment on hiv-1 gp120 Academic Article
Structural basis of latrophilin-FLRT-UNC5 interaction in cell adhesion Academic Article
Structural basis of neutralization by a human anti-severe acute respiratory syndrome spike protein antibody, 80R Academic Article
Structural basis of nucleoside and nucleoside drug selectivity by concentrative nucleoside transporters Academic Article
Structural basis of plasticity in T cell receptor recognition of a self peptide-MHC antigen Academic Article
Structural basis of preexisting immunity to the 2009 h1n1 pandemic influenza virus Academic Article
Structural basis of single-nucleotide polymorphisms in cytochrome P450 2C9 Academic Article
Structural basis of small-molecule aggregate induced inhibition of a protein protein interaction Academic Article
Structural basis of steroid hormone perception by the receptor kinase bri1 Academic Article
Structural basis of substrate methylation and inhibition of SMYD2 Academic Article
Structural basis of the suppressed catalytic activity of wild-type human glutathione transferase T1-1 compared to its W234R mutant Academic Article
Structural basis of tlr5-flagellin recognition and signaling Academic Article
Structural basis of tyrosine sulfation and VH-gene usage in antibodies that recognize the HIV type 1 coreceptor-binding site on gp120 Academic Article
Structural basis underlying the binding preference of human galectins-1,-3 and-7 for Galβ1-3/4GlcNAc Academic Article
Structural biochemistry of a type 2 rnase h: Rna primer recognition and removal during DNA replication Academic Article
Structural biology of viruses by the combination of electron cryomicroscopy and x-ray crystallography Academic Article
Structural changes that occur upon photolysis of the fe(ii)(a3)-co complex in the cytochrome ba(3)-oxidase of thermus thermophilus: A combined x-ray crystallographic and infrared spectral study demonstrates co binding to cu-b Academic Article
Structural characterization and epitope mapping of the glutamic acid/alanine-rich protein from Trypanosoma congolense: defining assembly on the parasite cell surface Academic Article
Structural characterization of S100A15 reveals a novel zinc coordination site among S100 proteins and altered surface chemistry with functional implications for receptor binding Academic Article
Structural characterization of a human Fc fragment engineered for lack of effector functions Academic Article
Structural characterization of a subtype-selective ligand reveals a novel mode of estrogen receptor antagonism Academic Article
Structural characterization of an early fusion intermediate of influenza virus hemagglutinin Academic Article
Structural characterization of anti-CCL5 activity of the tick salivary protein evasin-4 Academic Article
Structural characterization of enterobactin hydrolase IroE Academic Article
Structural characterization of human cytochrome P450 2C19: active site differences between P450s 2C8, 2C9, and 2C19 Academic Article
Structural characterization of the 1918 influenza virus h1n1 neuraminidase Academic Article
Structural characterization of the complex between alpha-naphthoflavone and human cytochrome P450 1B1 Academic Article
Structural characterization of three novel hydroxamate-based zinc chelating inhibitors of the clostridium botulinum serotype a neurotoxin light chain metalloprotease reveals a compact binding site resulting from 60/70 loop flexibility Academic Article
Structural characterization of zinc-deficient human superoxide dismutase and implications for ALS Academic Article
Structural commonalities among integral membrane enzymes Academic Article
Structural comparison of allogeneic and syngeneic T cell receptor-peptide-major histocompatibility complex complexes: a buried alloreactive mutation subtly alters peptide presentation substantially increasing V(beta) Interactions Academic Article
Structural comparison of bacterial and human iron-dependent phenylalanine hydroxylases: Similar fold, different stability and reaction rates Academic Article
Structural context for mobilization of a human tRNA synthetase from its cytoplasmic complex Academic Article
Structural delineation of a quaternary, cleavage-dependent epitope at the gp41-gp120 interface on intact HIV-1 Env trimers Academic Article
Structural determinants of glutathione transferases with azathioprine activity identified by DNA shuffling of alpha class members Academic Article
Structural dynamics of alpha-actinin-vinculin interactions Academic Article
Structural evaluation of potent NKT cell agonists: Implications for design of novel stimulatory ligands Academic Article
Structural evidence for an enolate intermediate in gfp fluorophore biosynthesis Academic Article
Structural evidence for substrate strain in antibody catalysis Academic Article
Structural factors that determine selectivity of a high fidelity DNA polymerase for deoxy-, dideoxy-, and ribonucleotides Academic Article
Structural features for functional selectivity at serotonin receptors Academic Article
Structural insight into pH-induced conformational changes within the native human transthyretin tetramer Academic Article
Structural insight into the low affinity between Thermotoga maritima CheA and CheB compared to their Escherichia coli/Salmonella typhimurium counterparts Academic Article
Structural insights into RNA encapsidation and helical assembly of the Toscana virus nucleoprotein Academic Article
Structural insights into charge pair interactions in triple helical collagen-like proteins Academic Article
Structural insights into enzyme regulation for inositol 1,4,5-trisphosphate 3-kinase B Academic Article
Structural insights into inhibition of bacillus anthracis sporulation by a novel class of non-heme globin sensor domains Academic Article
Structural insights into inhibition of lipid I production in bacterial cell wall synthesis Academic Article
Structural insights into neonatal Fc receptor-based recycling mechanisms Academic Article
Structural insights into the avian aicar transformylase mechanism Academic Article
Structural insights into the catalytic mechanism of bacterial guanosine-diphospho-D-mannose pyrophosphorylase and its regulation by divalent ions Academic Article
Structural insights into the design of nonpeptidic isothiazolidinone-containing inhibitors of protein-tyrosine phosphatase 1B Academic Article
Structural insights into the evolution of an antibody combining site Academic Article
Structural insights into the human and avian IMP cyclohydrolase mechanism via crystal structures with the bound XMP inhibitor Academic Article
Structural insights into the interaction of IL-33 with its receptors Academic Article
Structural insights into the mechanism of action of a biparatopic anti-HER2 antibody Academic Article
Structural insights into the mechanisms of drug resistance in HIV-1 protease NL4-3 Academic Article
Structural insights into the recognition of phosphopeptide by the FHA domain of kanadaptin Academic Article
Structural insights into the role of iron-histidine bond cleavage in nitric oxide-induced activation of H-NOX gas sensor proteins Academic Article
Structural insights into the substrate tunnel of Saccharomyces cerevisiae carbonic anhydrase Nce103 Academic Article
Structural interconversions modulate activity of escherichia coli ribonucleotide reductase Academic Article
Structural invariance of constitutively active and inactive mutants of acanthamoeba myosin ic bound to f-actin in the rigor and adp-bound states Academic Article
Structural mechanism for signal transduction in RXR nuclear receptor heterodimers Academic Article
Structural mechanism of GAF-regulated sigma(54) activators from Aquifex aeolicus Academic Article
Structural mechanism of abscisic acid binding and signaling by dimeric PYR1 Academic Article
Structural mechanisms of allostery and autoinhibition in JNK family kinases Academic Article
Structural origins of efficient proton abstraction from carbon by a catalytic antibody Academic Article
Structural plasticity and the evolution of antibody affinity and specificity Academic Article
Structural plasticity in the oestrogen receptor ligand-binding domain Academic Article
Structural plasticity of an aminoacyl-tRNA synthetase active site Academic Article
Structural rearrangement of ebola virus VP40 begets multiple functions in the virus life cycle Academic Article
Structural revision and total synthesis of caraphenol B and C Academic Article
Structural studies of FIV and HIV-1 proteases complexed with all efficient inhibitor of FIV protease Academic Article
Structural studies of human HIV-1 V3 antibodies Academic Article
Structural studies on phenylalanine hydroxylase and implications toward understanding and treating phenylketonuria Academic Article
Structural switch of lysyl-tRNA synthetase between translation and transcription Academic Article
Structural tuning of the fluorescent protein iLOV for improved photostability Academic Article
Structural variations in species B adenovirus fibers impact CD46 association Academic Article
Structural, functional, and immunogenic insights on Cu,Zn superoxide dismutase pathogenic virulence factors from Neisseria meningitidis and Brucella abortus Academic Article
Structural-analysis of antibody specificity - detailed comparison of 5 fab'-steroid complexes Academic Article
Structural-based analysis of dihydrofolate reductase evolution Academic Article
Structure Based Design of CYP51 Inhibitors Academic Article
Structure activity relationships of human galactokinase inhibitors Academic Article
Structure analysis of peptide deformylases from Streptococcus pneumoniae, Staphylococcus aureus, Thermotoga maritima and Pseudomonas aeruginosa: Snapshots of the oxygen sensitivity of peptide deformylase Academic Article
Structure and activity of a thermostable thymine-DNA glycosylase: Evidence for base twisting to remove mismatched normal DNA bases Academic Article
Structure and activity of the flagellar rotor protein FliY: a member of the CheC phosphatase family Academic Article
Structure and flexibility of nanoscale protein cages designed by symmetric self-assembly Academic Article
Structure and function of a genetically engineered mimic of a nonenveloped virus entry intermediate Academic Article
Structure and function of a membrane-bound murine MHC class I molecule Academic Article
Structure and function of a novel LD-carboxypeptidase A involved in peptidoglycan recycling Academic Article
Structure and function of a potent agonist for the semi-invariant natural killer T cell receptor Academic Article
Structure and function of an unusual family of protein phosphatases: the bacterial chemotaxis proteins CheC and CheX Academic Article
Structure and function of broadly reactive antibody PG16 reveal an H3 subdomain that mediates potent neutralization of HIV-1 Academic Article
Structure and function of the DUF2233 domain in bacteria and in the human mannose 6-phosphate uncovering enzyme Academic Article
Structure and function of the double-strand break repair machinery Academic Article
Structure and function of the first full-length murein peptide ligase (mpl) cell wall recycling protein Academic Article
Structure and function of the multifunctional DNA-repair enzyme exonuclease-iii Academic Article
Structure and functional characterization of a bile acid 7α dehydratase BaiE in secondary bile acid synthesis Academic Article
Structure and functional characterization of the rna-binding element of the nlrx1 innate immune modulator Academic Article
Structure and functional role of dynein's microtubule-binding domain Academic Article
Structure and hydride transfer mechanism of a moderate thermophilic dihydrofolate reductase from Bacillus stearothermophilus and comparison to its mesophilic and hyperthermophilic homologues Academic Article
Structure and internal dynamics of the bovine pancreatic trypsin-inhibitor in aqueous-solution from long-time molecular-dynamics simulations Academic Article
Structure and ligand binding of the soluble domain of a Thermotoga maritima membrane protein of unknown function TM1634 Academic Article
Structure and ligand-binding mechanism of the human OX1 and OX2 orexin receptors Academic Article
Structure and mechanism of Helicobacter pylori fucosyltransferase: a basis for lipopolysaccharide variation and inhibitor design Academic Article
Structure and mechanism of a bacterial beta-glucosaminidase having O-GlcNAcase activity Academic Article
Structure and mechanism of the ruvb holliday junction branch migration motor Academic Article
Structure and mechanistic analysis of the anti-human immunodeficiency virus type 1 antibody 2f5 in complex with its gp41 epitope Academic Article
Structure and mutational analysis of Rab GDP-dissociation inhibitor Academic Article
Structure and reactivity of an asymmetric complex between hslv and i-domain deleted hslu, a prokaryotic homolog of the eukaryotic proteasome Academic Article
Structure and receptor binding of the hemagglutinin from a human H6N1 influenza virus Academic Article
Structure and receptor binding specificity of hemagglutinin H13 from avian influenza A virus H13N6 Academic Article
Structure and receptor specificity of the hemagglutinin from an h5n1 influenza virus Academic Article
Structure and regulatory mechanism of Aquifex aeolicus NtrC4: variability and evolution in bacterial transcriptional regulation Academic Article
Structure and thermodynamic characterization of the ephb4/ephrin-b2 antagonist peptide complex reveals the determinants for receptor specificity Academic Article
Structure at 0.85 Å resolution of an early protein photocycle intermediate Academic Article
Structure determination of an anti-hiv-1 fab 447-52d-peptide complex from an epitaxially twinned data set Academic Article
Structure determination of naudaurelia capensis omega virus Academic Article
Structure determination of the 1918 h1n1 neuraminidase from a crystal with lattice-translocation defects Academic Article
Structure guided development of novel thymidine mimetics targeting Pseudomonas aeruginosa thymidylate kinase: from hit to lead generation Academic Article
Structure of BT_3984, a member of the SusD/RagB family of nutrient-binding molecules Academic Article
Structure of Bacteroides thetaiotaomicron BT2081 at 2.05 A resolution: The first structural representative of a new protein family that may play a role in carbohydrate metabolism Academic Article
Structure of HIV-1 gp120 V1/V2 domain with broadly neutralizing antibody PG9 Academic Article
Structure of LP2179, the first representative of Pfam family PF08866, suggests a new fold with a role in amino-acid metabolism Academic Article
Structure of P-glycoprotein reveals a molecular basis for poly-specific drug binding Academic Article
Structure of REV-ERB beta ligand-binding domain bound to a porphyrin antagonist Academic Article
Structure of SARS coronavirus spike receptor-binding domain complexed with receptor Academic Article
Structure of Saccharomyces cerevisiae Rtr1 reveals an active site for an atypical phosphatase Academic Article
Structure of Thermotoga maritima TM0439: Implications for the mechanism of bacterial GntR transcription regulators with Zn(2+)-binding FCD domains Academic Article
Structure of a PE-PPE-EspG complex from Mycobacterium tuberculosis reveals molecular specificity of ESX protein secretion Academic Article
Structure of a cation-bound multidrug and toxic compound extrusion transporter Academic Article
Structure of a central component of the yeast kinetochore: The Spc24p/Spc25p globular domain Academic Article
Structure of a class C GPCR metabotropic glutamate receptor 1 bound to an allosteric modulator Academic Article
Structure of a classical broadly neutralizing stem antibody in complex with a pandemic H2 hemagglutinin Academic Article
Structure of a classical broadly neutralizing stem antibody in complex with a pandemic h2 hemagglutinin Academic Article
Structure of a copper-mediated base pair in DNA Academic Article
Structure of a designed protein cage that self-assembles into a highly porous cube Academic Article
Structure of a dicationic monoimidazole lexitropsin bound to DNA Academic Article
Structure of a kinesin microtubule depolymerization machine Academic Article
Structure of a light-activated LOV protein dimer that regulates transcription Academic Article
Structure of a membrane-attack complex/perforin (MACPF) family protein from the human gut symbiont Bacteroides thetaiotaomicron Academic Article
Structure of a mutant EF-G reveals domain III and possibly the fusidic acid binding site Academic Article
Structure of a nitric oxide synthase heme protein from Bacillus subtilis Academic Article
Structure of a novel winged-helix like domain from human NFRKB protein Academic Article
Structure of a protein photocycle intermediate by millisecond time-resolved crystallography Academic Article
Structure of a putative NTP pyrophosphohydrolase: YP_001813558.1 from Exiguobacterium sibiricum 255-15 Academic Article
Structure of a substrate complex of mammalian cytochrome P450 2C5 at 2.3 A resolution: evidence for multiple substrate binding modes Academic Article
Structure of a thioredoxin-like 2fe-2s ferredoxin from aquifex aeolicus Academic Article
Structure of a trimeric nucleoporin complex reveals alternate oligomerization states Academic Article
Structure of a tryptophanyl-tRNA synthetase containing an iron-sulfur cluster Academic Article
Structure of a v3-containing hiv-1 gp120 core Academic Article
Structure of aart, a designed six-finger zinc finger peptide, bound to DNA Academic Article
Structure of an MmyB-like regulator from C-aurantiacus, member of a new transcription factor family linked to antibiotic metabolism in actinomycetes Academic Article
Structure of an agonist-bound human A₂A adenosine receptor Academic Article
Structure of an archaeal virus capsid protein reveals a common ancestry to eukaryotic and bacterial viruses Academic Article
Structure of an enclosed dimer formed by the Drosophila period protein Academic Article
Structure of an essential bacterial protein YeaZ (TM0874) from Thermotoga maritima at 2.5 A resolution Academic Article
Structure of an essential type iv pilus biogenesis protein provides insights into pilus and type ii secretion systems Academic Article
Structure of an hiv gp120 envelope glycoprotein in complex with the cd4 receptor and a neutralizing human antibody Academic Article
Structure of antibody f425-b4e8 in complex with a v3 peptide reveals a new binding mode for hiv-1 neutralization Academic Article
Structure of avian aicar transformylase with a multisubstrate adduct inhibitor β-DADF identifies the folate binding site Academic Article
Structure of azotobacter vinelandii 7fe ferredoxin at 1.35 Å resolution and determination of the fe-s bonds with 0.01 Å accuracy Academic Article
Structure of botulinurn neurotoxin type d light chain at 1.65 Å resolution: Repercussions for vamp-2 substrate specificity Academic Article
Structure of cardiac gap junction intercellular channels Academic Article
Structure of factor-inhibiting hypoxia-inducible factor 1: An asparaginyl hydroxylase involved in the hypoxic response pathway Academic Article
Structure of full-length Drosophila cryptochrome Academic Article
Structure of full-length hiv-1ca: A model for the mature capsid lattice Academic Article
Structure of hepatitis C virus envelope glycoprotein E1 antigenic site 314-324 in complex with antibody IGH526 Academic Article
Structure of hiv-1 gp120 with gp41-interactive region reveals layered envelope architecture and basis of conformational mobility Academic Article
Structure of mammalian cytochrome P450 2B4 complexed with 4-(4-chlorophenyl)imidazole at 1.9-A resolution: insight into the range of P450 conformations and the coordination of redox partner binding Academic Article
Structure of mammalian cytochrome P450 2C5 complexed with diclofenac at 2.1 A resolution: evidence for an induced fit model of substrate binding Academic Article
Structure of mammalian poly(adp- ribose) glycohydrolase reveals a flexible tyrosine clasp as a substrate-binding element Academic Article
Structure of microsomal cytochrome p4502b4 complexed with the antifungal drug bifonazole - insight into p450 conformational plasticity and membrane interaction Academic Article
Structure of native and expanded sobemoviruses by electron cryo-microscopy and image reconstruction Academic Article
Structure of nitric oxide synthase oxygenase dimer with pterin and substrate Academic Article
Structure of phaseolin at 2.2 Å resolution - implications for a common vicilin/legumin structure and the genetic-engineering of seed storage proteins Academic Article
Structure of tetrahydrobiopterin tunes its electron transfer to the heme-dioxy intermediate in nitric oxide synthase Academic Article
Structure of tetrameric human phenylalanine hydroxylase and its implications for phenylketonuria Academic Article
Structure of the Angiotensin receptor revealed by serial femtosecond crystallography Academic Article
Structure of the D2 dopamine receptor bound to the atypical antipsychotic drug risperidone Academic Article
Structure of the DNA repair enzyme endonuclease iv and its DNA complex: Double-nucleotide flipping at abasic sites and three-metal-ion catalysis Academic Article
Structure of the Lassa virus nucleoprotein reveals a dsRNA-specific 3' to 5' exonuclease activity essential for immune suppression Academic Article
Structure of the Reston ebolavirus VP30 C-terminal domain Academic Article
Structure of the S15,S6,S18-rRNA complex: assembly of the 30S ribosome central domain Academic Article
Structure of the apo anti-influenza CH65 Fab Academic Article
Structure of the bifunctional acyltransferase/decarboxylase lnmk from the leinamycin biosynthetic pathway revealing novel activity for a double-hot-dog fold Academic Article
Structure of the ebola virus glycoprotein bound to an antibody from a human survivor Academic Article
Structure of the fiber-forming protein pilin at 2.6 Å resolution Academic Article
Structure of the first representative of Pfam family PF04016 (DUF364) reveals enolase and rossmann-like folds that combine to form a unique active site with a possible role in heavy-metal chelation Academic Article
Structure of the first representative of pfam family pf09410 (duf2006) reveals a structural signature of the calycin superfamily that suggests a role in lipid metabolism Academic Article
Structure of the frequency-interacting RNA helicase: a protein interaction hub for the circadian clock Academic Article
Structure of the glucagon receptor in complex with a glucagon analogue Academic Article
Structure of the haemagglutinin-esterase-fusion glycoprotein of influenza c virus Academic Article
Structure of the human ATG12 similar to ATG5 conjugate required for LC3 lipidation in autophagy Academic Article
Structure of the human Cereblon-DDB1-lenalidomide complex reveals basis for responsiveness to thalidomide analogs Academic Article
Structure of the human P2Y(12) receptor in complex with an antithrombotic drug Academic Article
Structure of the human dopamine D3 receptor in complex with a D2/D3 selective antagonist Academic Article
Structure of the human glucagon class B G-protein-coupled receptor Academic Article
Structure of the human histamine h(1) receptor complex with doxepin Academic Article
Structure of the human lung cytochrome p450 2a13 Academic Article
Structure of the human smoothened receptor bound to an antitumour agent Academic Article
Structure of the human κ-opioid receptor in complex with JDTic Academic Article
Structure of the multidrug transporter emrd from escherichia coli Academic Article
Structure of the myotonic dystrophy type 2 RNA and designed small molecules that reduce toxicity Academic Article
Structure of the n terminus of cadherin 23 reveals a new adhesion mechanism for a subset of cadherin superfamily members Academic Article
Structure of the nociceptin/orphanin FQ receptor in complex with a peptide mimetic Academic Article
Structure of the pilus assembly protein TadZ from eubacterium rectale: Implications for polar localization Academic Article
Structure of the uncleaved human h1 hemagglutinin from the extinct 1918 influenza virus Academic Article
Structure of the wilms tumor suppressor protein zinc finger domain bound to DNA Academic Article
Structure of the zinc-binding domain of an essential component of the hepatitis C virus replicase Academic Article
Structure of the γ-D-glutamyl-L-diamino acid endopeptidase YkfC from Bacillus cereus in complex with L-Ala-γ-D-Glu: insights into substrate recognition by NlpC/P60 cysteine peptidases Academic Article
Structure of yeast RNA polymerase II in solution: Implications for enzyme regulation and interaction with promoter DNA Academic Article
Structure, biochemistry, and inhibition of essential 4'-phosphopantetheinyl transferases from two species of Mycobacteria Academic Article
Structure, receptor binding, and antigenicity of influenza virus hemagglutinins from the 1957 h2n2 pandemic Academic Article
Structure-activity relationship studies of novel carbocyclic influenza neuraminidase inhibitors Academic Article
Structure-activity relationships and X-ray structures describing the selectivity of aminopyrazole inhibitors for c-jun N-terminal kinase 3 (JNK3) over p38 Academic Article
Structure-based analysis of Bacilli and plasmid dihydrofolate reductase evolution Academic Article
Structure-based design and discovery of protein tyrosine phosphatase inhibitors incorporating novel isothiazolidinone heterocyclic phosphotyrosine mimetics Academic Article
Structure-based design and synthesis of highly potent SARS-CoV 3CL protease inhibitors Academic Article
Structure-based design and synthesis of potent and selective matrix metalloproteinase 13 inhibitors Academic Article
Structure-based design of a constrained peptide mimic of the HIV-1 V3 loop neutralization site Academic Article
Structure-based design of a protein immunogen that displays an hiv-1 gp41 neutralizing epitope Academic Article
Structure-based design of peptide presentation on a viral surface: The crystal structure of a plant/animal virus chimera at 2.8 Å resolution Academic Article
Structure-based design of thienobenzoxepin inhibitors of PI3-kinase Academic Article
Structure-based design, synthesis and evaluation of conformationally constrained cysteine protease inhibitors Academic Article
Structure-based discovery of C-2 substituted imidazo-pyrrolopyridine JAK1 inhibitors with improved selectivity over JAK2 Academic Article
Structure-based discovery of NANOG variant with enhanced properties to promote self-renewal and reprogramming of pluripotent stem cells Academic Article
Structure-based discovery of cellular-active allosteric inhibitors of FAK Academic Article
Structure-based engineering of internal cavities in coiled-coil peptides Academic Article
Structure-based mutagenesis approaches toward expanding the substrate specificity of d-2-deoxyribose-5-phosphate aldolase Academic Article
Structure-based optimization and synthesis of antiviral drug Arbidol analogues with significantly improved affinity to influenza hemagglutinin Academic Article
Structure-based optimization of pyrazolo-pyrimidine and -pyridine inhibitors of PI3-kinase Academic Article
Structure-based rationale for the rescue of systemic movement of brome mosaic virus by spontaneous second-site mutations in the coat protein gene Academic Article
Structure-based redesign of GST A2-2 for enhanced catalytic efficiency with azathioprine Academic Article
Structure-factor extrapolation using the scalar approximation: theory, applications and limitations Academic Article
Structure-function analysis of a phage display-derived peptide that binds to insulin-like growth factor binding protein 1 Academic Article
Structure-function-folding relationship in a WW domain Academic Article
Structure-guided expansion of kinase fragment libraries driven by support vector machine models Academic Article
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Structure-guided inhibitor design for human FAAH by interspecies active site conversion Academic Article
Structure-guided optimization of estrogen receptor binding affinity and antagonist potency of pyrazolopyrimidines with basic side chains Academic Article
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Structures of thermolabile mutants of human glutathione transferase P1-1 Academic Article
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Structures of virus and virus-like particles Academic Article
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Substitution of ribonucleotides in the T7 RNA polymerase promoter element Academic Article
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The structure of the nuclear pore complex Academic Article
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The three-dimensional arcitecture of the EJC core Academic Article
The three-dimensional structure of N-acetylneuraminate lyase from Escherichia coli Academic Article
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The true structures of the vannusals, part 2: Total synthesis and revised structure of vannusal B Academic Article
Thermodynamic and structure guided design of statin based inhibitors of 3-hydroxy-3-methylglutaryl coenzyme a reductase Academic Article
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Three-dimensional structure of human tryptophan hydroxylase and its implications for the biosynthesis of the neurotransmitters serotonin and melatonin Academic Article
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Unravelling the mechanism and significance of thrombin binding to platelet glycoprotein lb Academic Article
Unusual trigonal-planar copper configuration revealed in the atomic structure of yeast copper-zinc superoxide dismutase Academic Article
Uracil-DNA glycosylase-DNA substrate and product structures: Conformational strain promotes catalytic efficiency by coupled stereoelectronic effects Academic Article
Uranyl ion coordination with rigid aromatic carboxylates and structural characterization of their complexes Academic Article
Use of complementary cation and anion heavy-atom salt derivatives to solve the structure of cytochrome P450 46A1 Academic Article
Use of multiple anomalous dispersion to phase highly merohedrally twinned crystals of interleukin-1 beta Academic Article
Using AutoDock for ligand-receptor docking Academic Article
Using a quasi-parallel x-ray beam of ultrashort wavelength for high-pressure virus crystallography: Implications for standard macromolecular crystallography Academic Article
Using antibodies to perturb the coordination sphere of a transition metal complex Academic Article
Utilizing structures of CYP2D6 and BACE1 complexes to reduce risk of drug-drug interactions with a novel series of centrally efficacious BACE1 inhibitors Academic Article
Versatile approach for the synthesis of novel seven-membered iminocyclitols via ring-closing metathesis dihydroxylation reaction Academic Article
Versatile approaches for the synthesis of fused-ring γ-lactones utilizing cyclopropane intermediates Academic Article
Vinculin activation by talin through helical bundle conversion Academic Article
Vinculin binding in its closed conformation by a helix addition mechanism Academic Article
Virtual screening against acetylcholine binding protein Academic Article
Virus maturation involving large subunit rotations and local refolding Academic Article
Virus-like particles of a fish nodavirus display a capsid subunit domain organization different from that of insect nodaviruses Academic Article
Visualization of macromolecular structures Academic Article
Water--more than just a green solvent: a stereoselective one-pot access to all-chiral tetrahydronaphthalenes in aqueous media Academic Article
Water-mediated recognition of t1-adenosine anchors Argonaute2 to microRNA targets Academic Article
Why does TNA cross-pair more strongly with RNA than with DNA? An answer from X-ray analysis Academic Article
Wrn exonuclease structure and molecular mechanism imply an editing role in DNA end processing Academic Article
X-ray crystal structure of the cytochrome p450 2b4 active site mutant f297a in complex with clopidogrel: Insights into compensatory rearrangements of the binding pocket Academic Article
X-ray crystal structures of the WT and a hyper-accurate ribosome from Escherichia coli Academic Article
X-ray crystallographic analysis of alpha-ketoheterocycle inhibitors bound to a humanized variant of fatty acid amide hydrolase Academic Article
X-ray crystallographic determination of the structure of the influenza c virus haemagglutinin-esterase-fusion glycoprotein Academic Article
X-ray diffraction analysis of a crystal of HscA from Escherichia coli Academic Article
X-ray solution scattering (saxs) combined with crystallography and computation: Defining accurate macromolecular structures, conformations and assemblies in solution Academic Article
X-ray structure of NS1 from a highly pathogenic H5N1 influenza virus Academic Article
X-ray structure of emre supports dual topology model Academic Article
X-ray structure of human acid-beta-glucosidase covalently bound to conduritol-B-epoxide. Implications for Gaucher disease Academic Article
X-ray structure of influenza virus NS1 effector domain Academic Article
X-ray structure of junctional adhesion molecule: Structural basis for homophilic adhesion via a novel dimerization motif Academic Article
X-ray structures of the LXRα LBD in its homodimeric form and implications for heterodimer signaling Academic Article
X-ray structures of the hexameric building block of the HIV capsid Academic Article
X-shaped structure of bacterial heterotetrameric tRNA synthetase suggests cryptic prokaryote functions and a rationale for synthetase classifications Academic Article
Xiap induces nf-kappa b activation via the bir1/tab1 interaction and bir1 dimerization Academic Article
Xol-1, primary determinant of sexual fate in c. Elegans, is a ghmp kinase family member and a structural prototype for a class of developmental regulators Academic Article
Xpd helicase structures and activities: Insights into the cancer and aging phenotypes from xpd mutations Academic Article
Xrcc4 protein interactions with xrcc4-like factor (xlf) create an extended grooved scaffold for DNA ligation and double strand break repair Academic Article
Yatakemycin: Total synthesis, DNA alkylation, and biological properties Academic Article
Zinc-independent folate biosynthesis: genetic, biochemical, and structural investigations reveal new metal dependence for GTP cyclohydrolase IB Academic Article
alpha-Ketoheterocycle inhibitors of fatty acid amide hydrolase: exploration of conformational constraints in the acyl side chain Academic Article
gamma H2A binds Brc1 to maintain genome integrity during S-phase Academic Article
gp41: HIV's shy protein Academic Article
p RCSB Protein Data Bank resources for structure-facilitated design of mRNA vaccines for existing and emerging viral pathogens Academic Article
p38alpha MAP kinase C-terminal domain binding pocket characterized by crystallographic and computational analyses Academic Article
tRNA structure goes from L to lambda Academic Article
tRNA-controlled nuclear import of a human tRNA synthetase Academic Article
αβ T cell receptor interactions with syngeneic and allogeneic ligands: affinity measurements and crystallization Academic Article

Scripps VIVO

Crystallography, X-Ray

Overview

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