Citation Impact
Citing Papers
The T790M mutation in EGFR kinase causes drug resistance by increasing the affinity for ATP
2008 Standout
GPCR Engineering Yields High-Resolution Structural Insights into β 2 -Adrenergic Receptor Function
2007 StandoutScienceNobel
Tight and specific lanthanide binding in a de novo TIM barrel with a large internal cavity designed by symmetric domain fusion
2020 StandoutNobel
Computational design of closely related proteins that adopt two well-defined but structurally divergent folds
2020 StandoutNobel
Inverting family GH156 sialidases define an unusual catalytic motif for glycosidase action
2019 StandoutNobel
Carbon-Oxygen Hydrogen Bonding in Biological Structure and Function
2012
Improving physical realism, stereochemistry, and side‐chain accuracy in homology modeling: Four approaches that performed well in CASP8
2009 StandoutNobel
Engineering a high-affinity allosteric binding site for divalent cations in kainate receptors
2008
Potent and Selective Triazole-Based Inhibitors of the Hypoxia-Inducible Factor Prolyl-Hydroxylases with Activity in the Murine Brain
2015 StandoutNobel
Hirshfeld atom refinement
2014
Glutamate Receptor Ion Channels: Structure, Regulation, and Function
2010 Standout
Electron diffraction data processing withDIALS
2018
QM/MM Methods for Biomolecular Systems
2009 Standout
A quasi-Laue neutron crystallographic study of d-xylose isomerase
2006
A reversibly photoswitchable GFP-like protein with fluorescence excitation decoupled from switching
2011 StandoutNobel
RosettaScripts: A Scripting Language Interface to the Rosetta Macromolecular Modeling Suite
2011 StandoutNobel
Crystal Structure of Calf Spleen Purine Nucleoside Phosphorylase with Two Full Trimers in the Asymmetric Unit: Important Implications for the Mechanism of Catalysis
2004 StandoutNobel
PRODRG: a tool for high-throughput crystallography of protein–ligand complexes
2004 Standout
Enhancement of the Rate of Pyrophosphate Hydrolysis by Nonenzymatic Catalysts and by Inorganic Pyrophosphatase
2011
Marine natural products
1990 Standout
Joint X-ray and neutron refinement withphenix.refine
2010
Crystal structure refinement withSHELXL
2014 Standout
Structure-guided mutagenesis of a mucin-selective metalloprotease from Akkermansia muciniphila alters substrate preferences
2022 StandoutNobel
The Structures of Antibiotics Bound to the E Site Region of the 50 S Ribosomal Subunit of Haloarcula marismortui: 13-Deoxytedanolide and Girodazole
2007 StandoutNobel
REFMAC5 for the refinement of macromolecular crystal structures
2011 Standout
Overview of theCCP4 suite and current developments
2011 Standout
Psoriasis
2015 Standout
Recent developments inMrBUMP: better search-model preparation, graphical interaction with search models, and solution improvement and assessment
2018
Predicting Drug‐Resistant Mutations of HIV Protease
2007 StandoutNobel
MolProbity: all-atom contacts and structure validation for proteins and nucleic acids
2007 Standout
Optimization of the In-Silico-Designed Kemp Eliminase KE70 by Computational Design and Directed Evolution
2011 StandoutNobel
Emergence of a catalytic tetrad during evolution of a highly active artificial aldolase
2016 StandoutNobel
EGFR Mutation and Resistance of Non–Small-Cell Lung Cancer to Gefitinib
2005 Standout
MolProbity: all-atom structure validation for macromolecular crystallography
2009 Standout
Open and closed conformation of the E. coli purine nucleoside phosphorylase active center and implications for the catalytic mechanism
2002
Crystal Structure of the Non-heme Iron Dioxygenase PtlH in Pentalenolactone Biosynthesis
2007 StandoutNobel
Role of conformational sampling in computing mutation‐induced changes in protein structure and stability
2010 StandoutNobel
Programmable design of orthogonal protein heterodimers
2018 StandoutNatureNobel
New tools provide a second look at HDV ribozyme structure, dynamics and cleavage
2014 StandoutNobel
The Backrub Motion: How Protein Backbone Shrugs When a Sidechain Dances
2006
Industrial use of immobilized enzymes
2013
Quantitative exploration of the molecular origin of the activation of GTPase
2013 StandoutNobel
Dual Inhibitors for Aspartic Proteases HIV-1 PR and Renin: Advancements in AIDS–Hypertension–Diabetes Linkage via Molecular Dynamics, Inhibition Assays, and Binding Free Energy Calculations
2012
Grassystatins A−C from Marine Cyanobacteria, Potent Cathepsin E Inhibitors That Reduce Antigen Presentation
2009
Assigning the Protonation States of the Key Aspartates in β-Secretase Using QM/MM X-ray Structure Refinement
2006
Essential and Ubiquitous: The Emergence of Lanthanide Metallobiochemistry
2019
Triggering psoriasis: the role of infections and medications
2007
Rational HIV Immunogen Design to Target Specific Germline B Cell Receptors
2013 StandoutScienceNobel
The Organocatalytic Approach to Enantiopure 2H‐ and 3H‐Pyrroles: Inhibitors of the Hedgehog Signaling Pathway
2016 StandoutNobel
Tryptophan Synthase Uses an Atypical Mechanism To Achieve Substrate Specificity
2016 StandoutNobel
Crystal structure of Toll-like receptor adaptor MAL/TIRAP reveals the molecular basis for signal transduction and disease protection
2011 StandoutNobel
Structure of pyrrolysyl-tRNA synthetase, an archaeal enzyme for genetic code innovation
2007 StandoutNobel
De novo design of protein homo-oligomers with modular hydrogen-bond network–mediated specificity
2016 StandoutScienceNobel
Observation of the controlled assembly of preclick components in the in situ click chemistry generation of a chitinase inhibitor
2013 StandoutNobel
Structure-Based Design of β-Site APP Cleaving Enzyme 1 (BACE1) Inhibitors for the Treatment of Alzheimer’s Disease
2013
Rational Tuning of Fluorobenzene Probes for Cysteine‐Selective Protein Modification
2018 StandoutNobel
Oxygen Activation and Radical Transformations in Heme Proteins and Metalloporphyrins
2017
Biochemical Properties and Crystal Structure of a β-Phenylalanine Aminotransferase from Variovorax paradoxus
2012 StandoutNobel
Binding of Phosphinate and Phosphonate Inhibitors to Aspartic Proteases: A First-Principles Study
2005
Structural Investigations into the Stereochemistry and Activity of a Phenylalanine-2,3-aminomutase from Taxus chinensis
2014 StandoutNobel
Reactive Oxygen Species (ROS)-Based Nanomedicine
2019 Standout
Quantifying the Mechanism of Phosphate Monoester Hydrolysis in Aqueous Solution by Evaluating the Relevant Ab Initio QM/MM Free-Energy Surfaces
2013 StandoutNobel
Rapid biocompatible macrocyclization of peptides with decafluoro-diphenylsulfone
2016
Natural Products as Sources of New Drugs from 1981 to 2014
2016 Standout
Multimerization of an Alcohol Dehydrogenase by Fusion to a Designed Self-Assembling Protein Results in Enhanced Bioelectrocatalytic Operational Stability
2019 StandoutNobel
Catalysis and Linear Free Energy Relationships in Aspartic Proteases
2006
Design of Heme Enzymes with a Tunable Substrate Binding Pocket Adjacent to an Open Metal Coordination Site
2023 StandoutNobel
Combined Covalent-Electrostatic Model of Hydrogen Bonding Improves Structure Prediction with Rosetta
2015 StandoutNobel
Atomic Crystal and Molecular Dynamics Simulation Structures of Human Carbonic Anhydrase II: Insights into the Proton Transfer Mechanism,
2007
Hydroxymethylfurfural, A Versatile Platform Chemical Made from Renewable Resources
2013 Standout
Improving the Efficiency of Ligand-Binding Protein Design with Molecular Dynamics Simulations
2019 StandoutNobel
Iterative Molecular Dynamics–Rosetta Membrane Protein Structure Refinement Guided by Cryo-EM Densities
2017
Multiple Binding Modes of Inhibitors to Carbonic Anhydrases: How to Design Specific Drugs Targeting 15 Different Isoforms?
2012 Standout
Works of Leighton Coates being referenced
A Structural Study of CESA1 Catalytic Domain of Arabidopsis Cellulose Synthesis Complex: Evidence for CESA Trimers
2015
The atomic resolution structure of methanol dehydrogenase fromMethylobacterium extorquens
2004
Five Atomic Resolution Structures of Endothiapepsin Inhibitor Complexes: Implications for the Aspartic Proteinase Mechanism
2002
The 1.1 Å resolution structure of a periplasmic phosphate-binding protein fromStenotrophomonas maltophilia: a crystallization contaminant identified by molecular replacement using the entire Protein Data Bank
2016
Protein structures by spallation neutron crystallography
2008
High-resolution structure ofmyo-inositol monophosphatase, the putative target of lithium therapy
2005
Atomic resolution analysis of the catalytic site of an aspartic proteinase and an unexpected mode of binding by short peptides
2003
Molecular Mechanism of Enzymatic Chlorite Detoxification: Insights from Structural and Kinetic Studies
2017
Genetically Encoded Fragment-Based Discovery of Glycopeptide Ligands for Carbohydrate-Binding Proteins
2015
Hydrogen Location in Stages of an Enzyme-Catalyzed Reaction: Time-of-Flight Neutron Structure of d -Xylose Isomerase with Bound d -Xylulose
2008
Neutron diffraction studies of Escherichia coli dihydrofolate reductase complexed with methotrexate
2006
The Catalytic Mechanism of an Aspartic Proteinase Explored with Neutron and X-ray Diffraction
2008
A Neutron Laue Diffraction Study of Endothiapepsin: Implications for the Aspartic Proteinase Mechanism
2001
Locating active-site hydrogen atoms in d -xylose isomerase: Time-of-flight neutron diffraction
2006