Direct Observation of Protein Solvation and Discrete Disorder with Experimental Crystallographic Phases

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

1991 • 12,831 citations

Solvent content of protein crystals

1968 • 7,954 citations

Free R value: a novel statistical quantity for assessing the accuracy of crystal structures

1992 • 3,863 citations

X-PLOR Version 3.1: A System for X-ray Crystallography and NMR

1992 • 3,488 citations

Relativistic Calculation of Anomalous Scattering Factors for X Rays

1970 • 2,968 citations

Accurate bond and angle parameters for X-ray protein structure refinement

1991 • 2,467 citations

Determination of Macromolecular Structures from Anomalous Diffraction of Synchrotron Radiation

1991 • 1,123 citations

Dynamical transition of myoglobin revealed by inelastic neutron scattering

1989 • 1,104 citations

Molecular dynamics simulations in biology

1990 • 1,033 citations

Structure of a C-type mannose-binding protein complexed with an oligosaccharide

1992 • 873 citations

Structural Mechanisms for Domain Movements in Proteins

1994 • 741 citations

Crystal structure of globular domain of histone H5 and its implications for nucleosome binding

1993 • 739 citations

Stereochemically restrained refinement of macromolecular structures

1985 • 614 citations

Structure of the Calcium-Dependent Lectin Domain from a Rat Mannose-Binding Protein Determined by MAD Phasing

1991 • 547 citations

Slow-cooling protocols for crystallographic refinement by simulated annealing

1990 • 530 citations

Accurate simulation of protein dynamics in solution.

1988 • 442 citations

Model bias in macromolecular crystal structures

1992 • 397 citations

Torsion angle dynamics: Reduced variable conformational sampling enhances crystallographic structure refinement

1994 • 369 citations

Protein Hydration Observed by X-ray Diffraction

1994 • 343 citations

Water structure of a hydrophobic protein at atomic resolution: Pentagon rings of water molecules in crystals of crambin

1984 • 333 citations

Trimeric structure of a C-type mannose-binding protein

1994 • 312 citations

Maximum entropy and the foundations of direct methods

1984 • 281 citations

Structural and Functional Aspects of Domain Motions in Proteins

1984 • 246 citations

Hydrogen bonds involving sulfur atoms in proteins

1991 • 240 citations

Protein hydration elucidated by molecular dynamics simulation.

1993 • 239 citations

Water: now you see it, now you don't

1993 • 222 citations

Water and Biological Macromolecules

1993 • 189 citations

Calculation of anomalous scattering factors at arbitrary wavelengths

1983 • 184 citations

Effect of anisotropy and anharmonicity on protein crystallographic refinement

1986 • 172 citations

A global model of the protein-solvent interface

1994 • 154 citations

Physical characterization and crystallization of the carbohydrate-recognition domain of a mannose-binding protein from rat.

1991 • 111 citations

Exploration of disorder in protein structures by X‐ray restrained molecular dynamics

1991 • 103 citations

The use of molecular-replacement phases for the refinement of the human rhinovirus 14 structure

1988 • 98 citations

Automatic identification of discrete substates in proteins: Singular value decomposition analysis of time‐averaged crystallographic refinements

1995 • 79 citations

Thermal Motion and Conformational Disorder in Protein Crystal Structures: Comparison of Multi‐Conformer and Time‐Averaging Models

1994 • 75 citations

Anisotropy and anharmonicity of atomic fluctuations in proteins: Analysis of a molecular dynamics simulation

1987 • 73 citations

The use of anomalous scattering effects to phase diffraction patterns from macromolecules

1980 • 69 citations

Water structure in cubic insulin crystals.

1991 • 65 citations

A probability representation for phase information from multiwavelength anomalous dispersion

1990 • 58 citations

Localization of bound water in the solution structure of a complex of the erythroid transcription factor GATA-1 with DNA

1994 • 49 citations

Domain motions in proteins

1991 • 48 citations

A molecular dynamics study of solvent behavior around a protein

1993 • 47 citations

Anisotropy and anharmonicity of atomic fluctuations in proteins: implications for x-ray analysis

1988 • 35 citations

Isomorphous replacement: effects of errors on the phase probability distribution

1987 • 27 citations

Incorporation of experimental phases in a restrained least-squares refinement

1983 • 12 citations

Neutron diffraction analysis of the solvent accessible volume in cubic insulin crystals

1995 • 10 citations