Gherman, Benjamin F

Mixed quantum mechanical/molecular mechanical (QM/MM) study of the deacylation reaction in a penicillin binding protein (PBP) versus in a class C beta-lactamase. [electronic resource] - Journal of the American Chemical Society Jun 2004 - 7652-64 p. digital

Publication Type: Journal Article; Research Support, U.S. Gov't, Non-P.H.S.; Research Support, U.S. Gov't, P.H.S.

0002-7863

10.1021/ja036879a doi


Bacterial Proteins--chemistry
Carrier Proteins--chemistry
Cephalosporinase--chemistry
Cephalothin--chemistry
Enterobacter cloacae--enzymology
Hexosyltransferases--chemistry
Hydrolysis
Models, Molecular
Molecular Structure
Muramoylpentapeptide Carboxypeptidase--chemistry
Penicillin-Binding Proteins
Peptide Hydrolases--chemistry
Peptidyl Transferases--chemistry
Quantum Theory
Streptomyces--enzymology
beta-Lactamases--chemistry