On the calculation of ³Jαβ-coupling constants for side chains in proteins. (Q30418253)

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5 February 2020

title

On the calculation of ³Jαβ-coupling constants for side chains in proteins (English)

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2

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Wilfred F van Gunsteren

series ordinal

4

object named as

Wilfred F van Gunsteren

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author name string

Denise Steiner

series ordinal

1

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5 February 2020

Andreas P Eichenberger

series ordinal

3

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publication date

20 June 2012

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Journal of Biomolecular NMR

5 February 2020

published in

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volume

53

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issue

3

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page(s)

223-246

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A method to explore protein side chain conformational variability using experimental data

5 February 2020

cites work

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Contact Electron‐Spin Coupling of Nuclear Magnetic Moments

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High-resolution solution structure of reduced French bean plastocyanin and comparison with the crystal structure of poplar plastocyanin

21 January 2018

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A biomolecular force field based on the free enthalpy of hydration and solvation: the GROMOS force-field parameter sets 53A5 and 53A6

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Calibration of the angular dependence of the amide proton-C alpha proton coupling constants, 3JHN alpha, in a globular protein. Use of 3JHN alpha for identification of helical secondary structure

21 January 2018

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Self-consistent Karplus parametrization of 3J couplings depending on the polypeptide side-chain torsion chi1.

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Nuclear magnetic resonance provides a quantitative description of protein conformational flexibility on physiologically important time scales.

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Biomolecular structure refinement using the GROMOS simulation software

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Definition and testing of the GROMOS force-field versions 54A7 and 54B7

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Asymmetric Karplus curves for the protein side-chain 3J couplings

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Self-consistent 3J coupling analysis for the joint calibration of Karplus coefficients and evaluation of torsion angles

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An improved GROMOS96 force field for aliphatic hydrocarbons in the condensed phase

21 January 2018

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A refined solution structure of hen lysozyme determined using residual dipolar coupling data

21 January 2018

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An improved structural characterisation of reduced French bean plastocyanin based on NMR data and local-elevation molecular dynamics simulation

21 January 2018

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High-resolution structure (1.33 A) of a HEW lysozyme tetragonal crystal grown in the APCF apparatus. Data and structural comparison with a crystal grown under microgravity from SpaceHab-01 mission

21 January 2018

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Limits on variations in protein backbone dynamics from precise measurements of scalar couplings.

21 January 2018

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Interpreting Dynamically-Averaged Scalar Couplings in Proteins

21 January 2018

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Analysis of .vphi. and .chi.1 torsion angles for hen lysozyme in solution from proton NMR spin-spin coupling constants

21 January 2018

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On deriving spatial protein structure from NMR or X-ray diffraction data

21 January 2018

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12 December 2020

Accounting for molecular mobility in structure determination based on nuclear magnetic resonance spectroscopic and X-ray diffraction data

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12 December 2020

IUPAC-IUB Commission on Biochemical Nomenclature. Abbreviations and symbols for the description of the conformation of polypeptide chains. Tentative rules (1969)

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Cyclic peptides. I. Cyclo(tri-L-prolyl) and derivatives. Synthesis and molecular conformation from nuclear magnetic resonance

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Stereospecific assignments and chi 1 rotamers for FKBP when bound to ascomycin from 3JH alpha,H beta and 3HN,H beta coupling constants

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12 December 2020

10.1007/S10858-012-9634-5

Identifiers

DOI

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5 February 2020

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