Accurate modeling of protein conformation by automatic segment matching

Improved methods for building protein models in electron density maps and the location of errors in these models

1991 • 12,831 citations

The protein data bank: A computer-based archival file for macromolecular structures

1977 • 8,627 citations

The interpretation of protein structures: Estimation of static accessibility

1971 • 5,771 citations

A graphics model building and refinement system for macromolecules

1978 • 1,858 citations

Structure of ubiquitin refined at 1.8 Å resolution

1987 • 1,682 citations

Methods and applications

1953 • 1,648 citations

Stereochemical criteria for polypeptides and proteins. V. Conformation of a system of three linked peptide units

1968 • 1,497 citations

Tertiary templates for proteins

1987 • 1,485 citations

High-resolution crystal structure of cytochrome P450cam

1987 • 1,396 citations

Structure of Myoglobin: A Three-Dimensional Fourier Synthesis at 2 Å. Resolution

1960 • 1,313 citations

A discussion of the solution for the best rotation to relate two sets of vectors

1978 • 1,088 citations

Computer simulation of protein folding

1975 • 1,020 citations

Determination and analysis of the 2 Å structure of copper, zinc superoxide dismutase

1982 • 932 citations

Structure of prealbumin: Secondary, tertiary and quaternary interactions determined by Fourier refinement at 1.8 Å

1978 • 784 citations

Conformation of amino acid side-chains in proteins

1978 • 777 citations

Using known substructures in protein model building and crystallography.

1986 • 766 citations

The crystal structure of human deoxyhaemoglobin at 1.74 Å resolution

1984 • 738 citations

The Refined Structure of the Selenoenzyme Glutathione Peroxidase at 0.2‐nm Resolution

1983 • 676 citations

Knowledge-based prediction of protein structures and the design of novel molecules

1987 • 653 citations

Structure and refinement of oxymyoglobin at 1·6 Å resolution

1980 • 641 citations

The Three-Dimensional Structure of an Enzyme Molecule

1966 • 622 citations

Structure of the hydrophobic protein crambin determined directly from the anomalous scattering of sulphur

1981 • 621 citations

Structure of oxidized poplar plastocyanin at 1·6 Å resolution

1983 • 508 citations

Structure of papain refined at 1.65 Å resolution

1984 • 508 citations

Refined structure of glutathione reductase at 1.54 Å resolution

1987 • 498 citations

Structure of bovine pancreatic trypsin inhibitor

1984 • 470 citations

Crystallographic refinement and atomic models of the intact immunoglobulin molecule Kol and its antigen-binding fragment at 3.0 Å and 1.9 Å resolution

1980 • 455 citations

Structure of thermolysin refined at 1.6 Å resolution

1982 • 443 citations

Accurate simulation of protein dynamics in solution.

1988 • 442 citations

Refinement of the structure of carp muscle calcium-binding parvalbumin by model building and difference fourier analysis

1975 • 433 citations

Structure of bovine pancreatic phospholipase A2 at 1.7 Å resolution

1981 • 429 citations

Structure and refinement of penicillopepsin at 1.8 Å resolution

1983 • 405 citations

Refined crystal structure of carboxypeptidase a at 1·54 Å resolution

1983 • 391 citations

Structure of myohemerythrin in the azidomet state at resolution

1987 • 377 citations

Staphylococcal nuclease: Proposed mechanism of action based on structure of enzyme—thymidine 3′,5′-bisphosphate—calcium ion complex at 1.5-Å resolution

1979 • 375 citations

Protein folding by restrained energy minimization and molecular dynamics

1983 • 371 citations

The covalent and three-dimensional structure of concanavalin A. IV. Atomic coordinates, hydrogen bonding, and quaternary structure.

1975 • 362 citations

Structure of azurin from Alcaligenes denitrificans refinement at 1·8 Å resolution and comparison of the two crystallographically independent molecules

1988 • 361 citations

Molecular dynamics of native protein

1983 • 358 citations

Structure of bacteriophage T4 lysozyme refined at 1.7 Å resolution

1987 • 349 citations

A New Approach to the Rapid Determination of Protein Side Chain Conformations

1991 • 345 citations

Crystal structure of a retroviral protease proves relationship to aspartic protease family

1989 • 345 citations

The structure of melittin

1988 • 335 citations

Database algorithm for generating protein backbone and side-chain co-ordinates from a Cα trace

1991 • 324 citations

The structure of melittin. I. Structure determination and partial refinement.

1982 • 307 citations

Structure of erythrocruorin in different ligand states refined at 1·4 Å resolution

1979 • 304 citations

X-ray analysis of the eye lens protein γ-II crystallin at 1·9 Å resolution

1983 • 297 citations

Preliminary refinement and structural analysis of the Fab fragment from human immunoglobulin new at 2.0 A resolution.

1978 • 293 citations

Refined structure of baboon α-lactalbumin at 1.7 Å resolution

1989 • 286 citations

X-ray analysis (1. 4-Å resolution) of avian pancreatic polypeptide: Small globular protein hormone

1981 • 279 citations

Refined structure of chicken skeletal muscle troponin C in the two-calcium state at 2-A resolution.

1988 • 279 citations

Refinement of human lysozyme at 1.5 Å resolution analysis of non-bonded and hydrogen-bond interactions

1981 • 276 citations

Refined structure of cytochrome c3 at 1.8 Å resolution

1984 • 276 citations

Refined crystal structures of Escherichia coli and chicken liver dihydrofolate reductase containing bound trimethoprim.

1985 • 273 citations

An algorithm for determining the conformation of polypeptide segments in proteins by systematic search

1986 • 261 citations

Crystal and molecular structure of the serine proteinase inhibitor CI-2 from barley seeds

1987 • 260 citations

Structure of cytochrome c551 from Pseudomonas aeruginosa refined at 1.6 Å resolution and comparison of the two redox forms

1982 • 259 citations

Stabilization of phage T4 lysozyme by engineered disulfide bonds.

1989 • 245 citations

Two-Angstrom Crystal Structure of Oxidized Chromatium High Potential Iron Protein

1974 • 242 citations

The crystal structure of trp aporepressor at 1.8 Å shows how binding tryptophan enhances DNA affinity

1987 • 240 citations

Structure of human neutrophil elastase in complex with a peptide chloromethyl ketone inhibitor at 1.84-A resolution.

1989 • 231 citations

Prediction of protein side-chain conformation by packing optimization

1991 • 228 citations

A lattice model for protein structure prediction at low resolution.

1992 • 222 citations

Structure of the semiquinone form of flavodoxin from Clostridium MP

1977 • 221 citations

Predicting antibody hypervariable loop conformations II: Minimization and molecular dynamics studies of MCPC603 from many randomly generated loop conformations

1986 • 208 citations

Structure of the C-terminal domain of the ribosomal protein from Escherichia coli at 1.7 Å

1987 • 197 citations

Structure of the complex of Streptomyces griseus protease B and the third domain of the turkey ovomucoid inhibitor at 1.8-.ANG. resolution

1983 • 193 citations

Crystal structure determination, refinement and the molecular model of the α-amylase inhibitor Hoe-467A

1986 • 189 citations

Refined crystal structure of dogfish M4 apo-lactate dehydrogenase

1987 • 182 citations

Modelling the polypeptide backbone with ‘spare parts’ from known protein structures

1989 • 180 citations

Crystallographic studies of inhibitor binding sites in human carbonic anhydrase II: A pentacoordinated binding of the SCN⁻ ion to the zinc at high pH

1988 • 179 citations

Crystal structure of recombinant human interleukin-1β at 2·0 Å resolution

1989 • 177 citations

Refined structure of α-lytic protease at 1.7 Å resolution analysis of hydrogen bonding and solvent structure

1985 • 174 citations

Crystallographic and Modeling Methods in Molecular Design

1990 • 172 citations

Structure of ferricytochrome c′ from Rhodospirillum molischianum at 1.67 Å resolution

1985 • 166 citations

Ribonuclease-A: least-squares refinement of the structure at 1.45 Å resolution

1982 • 163 citations

Refined structure of spinach glycolate oxidase at 2 Å resolution

1989 • 156 citations

Structure of native porcine pancreatic elastase at 1.65 Å resolution

1988 • 155 citations

Refinement of the 7 Fe ferredoxin from Azotobacter vinelandii at 1.9 Å resolution

1989 • 147 citations

Refined 1.2 A crystal structure of the complex formed between subtilisin Carlsberg and the inhibitor eglin c. Molecular structure of eglin and its detailed interaction with subtilisin.

1986 • 147 citations

Chemistry of Peptides and Proteins

1981 • 126 citations

Rat submaxillary gland serine protease, tonin

1987 • 125 citations

Refinement of the C2221 crystal form of oxidized uteroglobin at 1.34 Å resolution

1987 • 123 citations

The refinement and the structure of the dimer of alpha-chymotrypsin at 1.67-A resolution.

1985 • 121 citations

Structure of the amino-terminal domain of phage 434 represser at 2.0 Å resolution

1989 • 120 citations

The crystal and molecular structure of the third domain of silver pheasant ovomucoid (OMSVP3)

1985 • 119 citations

Structure of a novel bence-jones protein (Rhe) fragment at 1·6 Å resolution

1983 • 117 citations

The structure of rat mast cell protease II at 1.9-angstrom resolution

1988 • 112 citations

Rubredoxin from Desulfovibrio gigas

1987 • 112 citations

Protein structure refinement: Streptomyces griseus serine protease A at 1.8 Å resolution

1979 • 109 citations

Structure of variant-3 scorpion neurotoxin from Centruroides sculpturatus ewing, refined at 1·8 Å resolution

1983 • 103 citations

The refinement and the structure of the dimer of alpha-chymotrypsin at 1.67-A resolution.

1985 • 100 citations

Refinement at 1.4 Å resolution of a model of erabutoxin b: treatment of ordered solvent and discrete disorder

1988 • 96 citations

Refinement of the crystal structure of wheat germ agglutinin isolectin 2 at 1.8 Å resolution

1987 • 96 citations

Dynamic Monte Carlo simulations of globular protein folding/unfolding pathways

1990 • 87 citations

Crystallographic refinement of the structure of actinidin at 1.7 Å resolution by fast Fourier least-squares methods

1980 • 85 citations

Three-dimensional structure of neurotoxin a from venom of the Philippines sea snake.

1977 • 84 citations

Rebuilding flavodoxin from Cα coordinates: A test study

1989 • 84 citations

Difference Fourier refinement of the structure of DIP-trypsin at 1.5 Å with a minicomputer technique

1977 • 74 citations

The crystal structure of pseudoazurin from Alcaligenes faecalis S‐6 determined at 2.9 Å resolution

1987 • 62 citations

The building of protein structures form α‐carbon coordinates

1990 • 62 citations

Synchrotron X-ray data collection and restrained least-squares refinement of the crystal structure of proteinase K at 1.5 Å resolution

1988 • 54 citations

Adjustment of restraints in the refinement of methemerythrin and azidomethemerythrin at 2.0 Å resolution

1983 • 47 citations

Structure of insulin: results of joint neutron and X-ray refinement

1989 • 34 citations

Three-dimensional structure of neurotoxin a from venom of the Philippines sea snake

1978 • 8 citations