Integrating In Silico and In vitro Approaches to Dissect the Stereoselectivity of Bacillus subtilis Lipase A toward Ketoprofen Vinyl Ester

Chemical Biology and Drug Design

Volumn 78, Issue 2, 2011, Pages 301-308

  Ni, Zhong ^a   Zhou, Peng ^a   Jin, Xin ^a   Lin, Xian Fu ^a  

^a ZHEJIANG UNIVERSITY   (China)

Author keywords

B. subtilis lipase A; Molecular docking; Quantum mechanical molecular mechanical; Stereoselectivity

Indexed keywords

ACID LIPASE; BACTERIAL ENZYME; KETOPROFEN DERIVATIVE;

ARTICLE; BACILLUS SUBTILIS; COMPUTER MODEL; CONTROLLED STUDY; ENANTIOMER; ENZYME SUBSTRATE COMPLEX; IN VITRO STUDY; MOLECULAR DOCKING; MOLECULAR MECHANICS; NONHUMAN; PRIORITY JOURNAL; STEREOCHEMISTRY;

BACILLUS SUBTILIS; BINDING SITES; COMPUTER SIMULATION; CRYSTALLOGRAPHY, X-RAY; ESTERS; KETOPROFEN; LIPASE; MODELS, CHEMICAL; MOLECULAR STRUCTURE; PROTEIN ENGINEERING; STEREOISOMERISM; VINYL COMPOUNDS;

BACILLUS SUBTILIS;

EID: 79960360531     PISSN: 17470277     EISSN: 17470285     Source Type: Journal    
DOI: 10.1111/j.1747-0285.2011.01097.x     Document Type: Article

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