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Explicit solvent molecular dynamics simulations of chaperonin-assisted rhodanese folding
Ren, Ying1,2; Gao, Jian1; Xu, Ji1,2; Ge, Wei1; Li, Jinghai1; Gao, J
2009-06-01
Source PublicationPARTICUOLOGY
ISSN1674-2001
Volume7Issue:3Pages:220-224
AbstractChaperonins are known to facilitate the productive folding of numerous misfolded proteins. Despite their established importance, the mechanism of chaperonin-assisted protein folding remains unknown. In the present article, all-atom explicit solvent molecular dynamics (MD) simulations have been performed for the first time on rhodanese folding in a series of cavity-size and cavity-charge chaperonin mutants. A compromise between stability and flexibility of chaperonin structure during the substrate folding has been observed and the key factors affecting this dynamic process are discussed. (C) 2009 Chinese Society of Particuology and Institute of Process Engineering, Chinese Academy of Sciences. Published by Elsevier B.V. All rights reserved.
KeywordMolecular Dynamics Simulation Explicit Solvent Chaperonin-assisted Protein Folding Molecular Chaperonin Rhodanese
SubtypeArticle
WOS HeadingsScience & Technology ; Technology
DOI10.1016/j.partic.2009.03.001
Indexed BySCI
Language英语
WOS KeywordPROTEIN ; COMPLEX ; CAGE
WOS Research AreaEngineering ; Materials Science
WOS SubjectEngineering, Chemical ; Materials Science, Multidisciplinary
WOS IDWOS:000266862500010
Citation statistics
Cited Times:1[WOS]   [WOS Record]     [Related Records in WOS]
Document Type期刊论文
Version出版稿
Identifierhttp://ir.ipe.ac.cn/handle/122111/6665
Collection多相复杂系统国家重点实验室
Corresponding AuthorGao, J
Affiliation1.Chinese Acad Sci, Inst Proc Engn, State Key Lab Multiphase Complex Syst, Beijing 100190, Peoples R China
2.Chinese Acad Sci, Grad Univ, Beijing 100039, Peoples R China
Recommended Citation
GB/T 7714
Ren, Ying,Gao, Jian,Xu, Ji,et al. Explicit solvent molecular dynamics simulations of chaperonin-assisted rhodanese folding[J]. PARTICUOLOGY,2009,7(3):220-224.
APA Ren, Ying,Gao, Jian,Xu, Ji,Ge, Wei,Li, Jinghai,&Gao, J.(2009).Explicit solvent molecular dynamics simulations of chaperonin-assisted rhodanese folding.PARTICUOLOGY,7(3),220-224.
MLA Ren, Ying,et al."Explicit solvent molecular dynamics simulations of chaperonin-assisted rhodanese folding".PARTICUOLOGY 7.3(2009):220-224.
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