Molecular dynamics simulations of interaction between protein-tyrosine phosphatase 1B and a bidentate inhibitor

Acta Pharmacologica Sinica

Volumn 27, Issue 1, 2006, Pages 100-110

  Liu, Gui Xia ^a,b   Tan, Jin Zhi ^a   Niu, Chun Ying ^a   Shen, Jian Hua ^a,b   Luo, Xiao Min ^a   Shen, Xu ^a,b   Chen, Kai Xian ^a   Jiang, Hua Liang ^a,b  

^a SHANGHAI INSTITUTE OF MATERIA MEDICA   (China)

^b EAST CHINA UNIVERSITY OF SCIENCE AND TECHNOLOGY   (China)

Author keywords

Molecular dynamics simulation; Principal component analysis; Protein tyrosine phosphatase 1B; Type 2 diabetes

Indexed keywords

ARGININE; LYSINE; PROTEIN TYROSINE PHOSPHATASE 1B; PROTEIN TYROSINE PHOSPHATASE INHIBITOR;

ARTICLE; BINDING SITE; COMPLEX FORMATION; CONFORMATION; DRUG POTENCY; DRUG PROTEIN BINDING; DRUG STRUCTURE; ELECTRICITY; MOLECULAR DYNAMICS; PRINCIPAL COMPONENT ANALYSIS;

BINDING SITES; COMPUTER SIMULATION; ENZYME INHIBITORS; KINETICS; LIGANDS; PRINCIPAL COMPONENT ANALYSIS; PROTEIN BINDING; PROTEIN CONFORMATION; PROTEIN STRUCTURE, SECONDARY; PROTEIN-TYROSINE-PHOSPHATASE;

EID: 30144443993     PISSN: 16714083     EISSN: None     Source Type: Journal    
DOI: 10.1111/j.1745-7254.2006.00251.x     Document Type: Article

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