The planar conformation of a strained proline ring: A QM/MM study

Proteins: Structure, Function and Genetics

Volumn 64, Issue 3, 2006, Pages 700-710

  Donnini, Serena ^a   Groenho, Gerrit ^b   Wierenga, Rik K ^a   Juffer, André H ^a  

^a UNIVERSITY OF OULU   (Finland)

^b MAX PLANCK INSTITUTE FOR BIOPHYSICAL CHEMISTRY   (Germany)

Author keywords

Active site; Force field; MD; Proline puckers; Strain; Triosephosphate isomerase

Indexed keywords

PROLINE; TRIOSEPHOSPHATE ISOMERASE;

AMINO ACID COMPOSITION; ARTICLE; CATALYSIS; CONFORMATIONAL TRANSITION; ENZYME ACTIVE SITE; ENZYME CONFORMATION; LIGAND BINDING; MOLECULAR INTERACTION; PRIORITY JOURNAL; STEREOCHEMISTRY;

EID: 84962448531     PISSN: 08873585     EISSN: 10970134     Source Type: Journal    
DOI: 10.1002/prot.21006     Document Type: Article

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