Understanding the acylation mechanisms of active-site serine penicillin-recognizing proteins: A molecular dynamics simulation study

Proteins: Structure, Function and Genetics

Volumn 53, Issue 1, 2003, Pages 88-100

  Oliva, Mónica ^a   Dideberg, Otto ^a   Field, Martin J ^a,b  

^a CEA GRENOBLE   (France)

^b INSTITUT DE BIOLOGIE STRUCTURALE   (France)

Author keywords

lactamases; Acylation mechanism; Hybrid QM MM potentials; Molecular dynamics; Penicillin binding proteins

Indexed keywords

BETA LACTAM ANTIBIOTIC; BETA LACTAMASE; PENICILLIN BINDING PROTEIN;

ACYLATION; ARTICLE; COMPUTER SIMULATION; ENZYME ACTIVE SITE; ENZYME SUBSTRATE COMPLEX; MOLECULAR DYNAMICS; PKA; PRIORITY JOURNAL; PROTON TRANSPORT; QUANTUM MECHANICS; STREPTOCOCCUS PNEUMONIAE; STREPTOMYCES; THEORETICAL STUDY;

ACYLATION; BACTERIAL PROTEINS; BETA-LACTAMASES; BINDING SITES; CARRIER PROTEINS; COMPUTER SIMULATION; HEXOSYLTRANSFERASES; HYDROGEN BONDING; MACROMOLECULAR SUBSTANCES; MODELS, MOLECULAR; MURAMOYLPENTAPEPTIDE CARBOXYPEPTIDASE; PENICILLIN-BINDING PROTEINS; PENICILLINS; PEPTIDYL TRANSFERASES; SERINE;

STREPTOCOCCUS; STREPTOCOCCUS PNEUMONIAE; STREPTOMYCES;

EID: 0042320537     PISSN: 08873585     EISSN: None     Source Type: Journal    
DOI: 10.1002/prot.10450     Document Type: Article

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