中国科学院机构知识库网格
Chinese Academy of Sciences Institutional Repositories Grid
Exploring the autoinhibition mechanism of the C-terminal guanine nucleotide exchange factor module of Trio through molecular dynamics simulations

文献类型:期刊论文

作者Zhang, Yuxin1,2
刊名CHEMICAL PHYSICS LETTERS
出版日期2019-09-01
卷号730页码:100-104
关键词TrioC DH-PH interface MD Hydrogen bond
ISSN号0009-2614
DOI10.1016/j.cplett.2019.05.049
通讯作者Zhang, Yuxin(zyx19840227@126.com)
英文摘要In this work, we carried out molecular dynamic simulations and hydrogen bonds analyses of the wild type TrioC and R2150A mutant respectively, and compared our results with the experimental observations. In either of the two systems, a stable hydrogen bonds network is formed near the DH-PH interface, contributing to maintaining the autoinhibited conformation of TrioC. Our work could be beneficial for the design of a small-molecule stabilizer of the autoinhibited TrioC conformation.
WOS关键词RHO-GTPASES ; CRYSTAL-STRUCTURE ; HOMOLOGY DOMAIN ; BINDING ; AMBER
WOS研究方向Chemistry ; Physics
语种英语
WOS记录号WOS:000478561700016
出版者ELSEVIER
源URL[http://cas-ir.dicp.ac.cn/handle/321008/173884]  
专题大连化学物理研究所_中国科学院大连化学物理研究所
通讯作者Zhang, Yuxin
作者单位1.Chinese Acad Sci, Dalian Inst Chem Phys, State Key Lab Mol React Dynam, Zhongshan Rd 457, Dalian 116023, Peoples R China
2.Univ Chinese Acad Sci, Beijing 100049, Peoples R China
推荐引用方式
GB/T 7714
Zhang, Yuxin. Exploring the autoinhibition mechanism of the C-terminal guanine nucleotide exchange factor module of Trio through molecular dynamics simulations[J]. CHEMICAL PHYSICS LETTERS,2019,730:100-104.
APA Zhang, Yuxin.(2019).Exploring the autoinhibition mechanism of the C-terminal guanine nucleotide exchange factor module of Trio through molecular dynamics simulations.CHEMICAL PHYSICS LETTERS,730,100-104.
MLA Zhang, Yuxin."Exploring the autoinhibition mechanism of the C-terminal guanine nucleotide exchange factor module of Trio through molecular dynamics simulations".CHEMICAL PHYSICS LETTERS 730(2019):100-104.

入库方式: OAI收割

来源:大连化学物理研究所

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