Accurate protein crystallography at ultra-high resolution: valence electron distribution in crambin - sprookjes - yvandenbroek - TriplyDB

Accurate protein crystallography at ultra-high resolution: valence electron distribution in crambin

Accurate protein crystallography at ultra-high resolution: valence electron distribution in crambin

http://www.wikidata.org/entity/Q27621905

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Sub-atomic resolution X-ray crystallography and neutron crystallography: promise, challenges and potential On the nature of a glassy state of matter in a hydrated protein: Relation to protein function The Refined Crystal Structure of an Eel Pout Type III Antifreeze Protein RD1 at 0.62-Å Resolution Reveals Structural Microheterogeneity of Protein and Solvation The crystal structure of a novel, inactive, lysine 49 PLA2 from Agkistrodon acutus venom: an ultrahigh resolution, AB initio structure determination High regularity of Z-DNA revealed by ultra high-resolution crystal structure at 0.55 A Crystal structure of small protein crambin at 0.48 Å resolution Direct observation of hydrogen atom dynamics and interactions by ultrahigh resolution neutron protein crystallography Room-temperature ultrahigh-resolution time-of-flight neutron and X-ray diffraction studies of H/D-exchanged crambin Invariom refinement of a new monoclinic solvate of thiostrepton at 0.64 Å resolution Cholesterol oxidase: ultrahigh-resolution crystal structure and multipolar atom model-based analysis Antimicrobial Peptides from Plants Topological Properties of Chemical Bonds from Static and Dynamic Electron Densities Biophysical highlights from 54 years of macromolecular crystallography X-ray solution scattering (SAXS) combined with crystallography and computation: defining accurate macromolecular structures, conformations and assemblies in solution Protein structure elucidation from NMR proton densities.Force Field for Peptides and Proteins based on the Classical Drude Oscillator Metal Ion Modeling Using Classical Mechanics An approach to creating a more realistic working model from a protein data bank entry Protein crystallography for non-crystallographers, or how to get the best (but not more) from published macromolecular structures.Probing the influence of non-covalent contact networks identified by charge density analysis on the oxidoreductase BacC.The Polarizable Atomic Multipole-based AMOEBA Force Field for Proteins.Solvent-induced differentiation of protein backbone hydrogen bonds in calmodulin.Sub-angstrom conformational changes of a single molecule captured by AFM variance analysis.Three-dimensional structure of the water-insoluble protein crambin in dodecylphosphocholine micelles and its minimal solvent-exposed surface On macromolecular refinement at subatomic resolution with interatomic scatterers.Electron density of two bioactive oligocyclic indole and oxindole derivatives obtained from low-order X-ray data and invariom application.Locating active-site hydrogen atoms in D-xylose isomerase: time-of-flight neutron diffraction Application of charge density methods to a protein model compound: calculation of Coulombic intermolecular interaction energies from the experimental charge density.Impact of synchrotron radiation on macromolecular crystallography: a personal view Electrostatic complementarity in an aldose reductase complex from ultra-high-resolution crystallography and first-principles calculations High-resolution crystal structures of protein helices reconciled with three-centered hydrogen bonds and multipole electrostatics.Hydrogen atoms in proteins: positions and dynamics.Structure Refinement at Atomic Resolution.Critical assessment of quantum mechanics based energy restraints in protein crystal structure refinement Structural dependencies of protein backbone 2JNC' couplings Optimization of the additive CHARMM all-atom protein force field targeting improved sampling of the backbone φ, ψ and side-chain χ(1) and χ(2) dihedral angles.Quantum crystallographic charge density of urea.Multistart simulated annealing refinement of the crystal structure of the 70S ribosome.Distribution of valence electrons of the flavin cofactor in NADH-cytochrome b5 reductase.Contributions of charge-density research to medicinal chemistry.

P2860

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P2860

Accurate protein crystallography at ultra-high resolution: valence electron distribution in crambin

http://www.wikidata.org/entity/Q27621905

description

2000 nî lūn-bûn

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2000 թուականի Մարտին հրատարակուած գիտական յօդուած

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2000 թվականի մարտին հրատարակված գիտական հոդված

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2000年の論文

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Accurate protein crystallograp ...... ectron distribution in crambin

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Accurate protein crystallograp ...... ectron distribution in crambin

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Accurate protein crystallograp ...... ectron distribution in crambin

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Accurate protein crystallograp ...... ectron distribution in crambin

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Proceedings of the National Academy of Sciences of the United States of America

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Accurate protein crystallograp ...... ectron distribution in crambin

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C Jelsch

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P2860

MOLSCRIPT: a program to produce both detailed and schematic plots of protein structures

Processing of X-ray diffraction data collected in oscillation mode

Atomic resolution (0.83 A) crystal structure of the hydrophobic protein crambin at 130 K

Crystal structure of Ser-22/Ile-25 form crambin confirms solvent, side chain substate correlations

Orbital steering in the catalytic power of enzymes: small structural changes with large catalytic consequences

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

SHELXL: high-resolution refinement

Full-matrix refinement of the protein crambin at 0.83 A and 130 K.

Molecular electrostatic potentials from crystal diffraction: the neurotransmitter gamma-aminobutyric acid.

The benefits of atomic resolution.

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