Conformational dynamics in penicillin-binding protein 2a of methicillin-resistant staphylococcus aureus, allosteric communication network and enablement of catalysis

Journal of the American Chemical Society

Volumn 139, Issue 5, 2017, Pages 2102-2110

  Mahasenan, Kiran V ^a   Molina, Rafael ^b   Bouley, Renee ^a   Batuecas, María T ^b   Fisher, Jed F ^a   Hermoso, Juan A ^b   Chang, Mayland ^a   Mobashery, Shahriar ^a  

^a UNIVERSITY OF NOTRE DAME   (United States)

^b INSTITUTO DE QUÍMICA FÍSICA ROCASOLANO   (Spain)

Author keywords

[No Author keywords available]

Indexed keywords

ANTIBIOTICS; BACTERIA; BIOCHEMISTRY; BIOSYNTHESIS; CATALYSIS; COMPLEX NETWORKS; CRYSTAL STRUCTURE; ENZYMES; PROTEINS; SUBSTRATES;

ALLOSTERIC COMMUNICATION; COMPUTATIONAL SIMULATION; CONFORMATIONAL DYNAMICS; CRYSTALLOGRAPHIC STUDIES; GRAM-POSITIVE PATHOGENS; METHICILLIN-RESISTANT STAPHYLOCOCCUS AUREUS; PENICILLIN- BINDING PROTEINS; X RAY CRYSTAL STRUCTURES;

BINS;

CEFEPIME; CEFTAZIDIME; OXACILLIN; PENICILLIN BINDING PROTEIN 2A; PEPTIDOGLYCAN; BACTERIAL PROTEIN; MECA PROTEIN, STAPHYLOCOCCUS AUREUS; PENICILLIN BINDING PROTEIN;

ARTICLE; BINDING SITE; CATALYSIS; CHEMICAL STRUCTURE; CONFORMATIONAL TRANSITION; CRYSTAL STRUCTURE; ENZYME SUBSTRATE COMPLEX; HYDROGEN BOND; LIGAND BINDING; METHICILLIN RESISTANT STAPHYLOCOCCUS AUREUS; MOLECULAR DYNAMICS; NONHUMAN; PROTEIN CROSS LINKING; SIMULATION; STATIC ELECTRICITY; ALLOSTERISM; BIOCATALYSIS; CHEMISTRY; METABOLISM; MOLECULAR MODEL; PROTEIN CONFORMATION; THERMODYNAMICS; X RAY CRYSTALLOGRAPHY;

ALLOSTERIC REGULATION; BACTERIAL PROTEINS; BIOCATALYSIS; CRYSTALLOGRAPHY, X-RAY; METHICILLIN-RESISTANT STAPHYLOCOCCUS AUREUS; MODELS, MOLECULAR; MOLECULAR STRUCTURE; PENICILLIN-BINDING PROTEINS; PROTEIN CONFORMATION; THERMODYNAMICS;

EID: 85012005060     PISSN: 00027863     EISSN: 15205126     Source Type: Journal    
DOI: 10.1021/jacs.6b12565     Document Type: Article

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