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Molecular dynamics simulations of peptide fragments from hen lysozyme: insight into non-native protein conformations.

Abstract:

Molecular dynamics simulations of four peptides taken from the hen lysozyme sequence have been used to generate models for non-native protein conformations. Comparisons between the different peptides and with experimental data for denatured lysozyme and peptide fragments provides insight into the characteristics of the conformational ensembles populated in these non-native states and the dependence of their structural features on the amino acid sequence. For the denatured conformers populated...

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Publication status:
Published

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Publisher copy:
10.1006/jmbi.1998.1892

Authors


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Institution:
University of Oxford
Department:
Oxford, MPLS, Chemistry, Inorganic Chemistry
Role:
Author
Journal:
Journal of molecular biology
Volume:
280
Issue:
4
Pages:
703-719
Publication date:
1998-07-05
DOI:
EISSN:
1089-8638
ISSN:
0022-2836
URN:
uuid:a76106c7-1b2f-41dc-a45a-a72495352077
Source identifiers:
36209
Local pid:
pubs:36209

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