Exploring the binding mechanism of a small molecular Hsp70-Bim PPI inhibitor through molecular dynamic simulation.

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第一作者： Xin,Li

第一单位： Cancer Hospital of Dalian University of Technology, School of Chemistry, Dalian University of Technology, Dalian, Liaoning, China.

作者： Xin,Li ^[1] ; Yuying,Wang ^[2] ; Maojun,Jiang ^[1] ; Fangkui,Yin ^[1] ; Hong,Zhang ^[1] ; Linjie,Yuan ^[1] ; Jingjing,Liu ^[2] ; Xingyu,Wang ^[2] ; Ziqian,Wang ^[3] ; Zhichao,Zhang ^[4]

作者单位： Cancer Hospital of Dalian University of Technology, School of Chemistry, Dalian University of Technology, Dalian, Liaoning, China. ^[1] Cancer Hospital of Dalian University of Technology, School of Life Science and Technology, Dalian University of Technology, Dalian, Liaoning, China. ^[2] Cancer Hospital of Dalian University of Technology, School of Chemistry, Dalian University of Technology, Dalian, Liaoning, China. wangziqian@dlut.edu.cn. ^[3] Cancer Hospital of Dalian University of Technology, School of Chemistry, Dalian University of Technology, Dalian, Liaoning, China. zczhang@dlut.edu.cn. ^[4]

关键词 Heat shock protein 70 Hot-spot Hsp70/Bim heterodimers Molecular Dynamic simulation Protein–Protein Interaction

主题词分子动力学模拟(Molecular Dynamics Simulation);HSP70热休克蛋白质类(HSP70 Heat-Shock Proteins);结合部位(Binding Sites);碱基序列(Base Sequence)

DOI 10.1007/s00894-024-05874-8

PMID 38351232

发布时间 2024-03-15

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准确一般字义偏差语意偏离译文作用小提交