Mechanism of autophosphorylation of mycobacterial PknB explored by molecular dynamics simulations

Biochemistry

Volumn 53, Issue 28, 2014, Pages 4715-4726

  Damle, Nikhil P ^a   Mohanty, Debasisa ^a  

^a NATIONAL INSTITUTE OF IMMUNOLOGY   (India)

Author keywords

[No Author keywords available]

Indexed keywords

CHAINS; COMPUTER SIMULATION; CONFORMATIONS; ENZYMES; MOLECULAR DYNAMICS; MONOMERS; PHOSPHORYLATION; REACTION KINETICS;

AUTOPHOSPHORYLATION; CATALYTIC DOMAINS; CONFORMATIONAL CHANGE; CONFORMATIONAL TRANSITIONS; DIFFERENTIAL NETWORK; EXPLICIT SOLVENT MOLECULAR DYNAMICS; HYDROPHOBIC RESIDUES; MOLECULAR DYNAMICS SIMULATIONS;

CHEMICAL ACTIVATION;

BACTERIAL ENZYME; MONOMER; MYCOBACTERIAL PKNB; UNCLASSIFIED DRUG;

ARTICLE; AUTOPHOSPHORYLATION; CHEMICAL REACTION KINETICS; CONFORMATIONAL TRANSITION; CRYSTAL STRUCTURE; ENZYME ACTIVE SITE; ENZYME PHOSPHORYLATION; ENZYME STRUCTURE; HYDROPHOBICITY; MOLECULAR DYNAMICS; NONHUMAN; PRIORITY JOURNAL; STATIC ELECTRICITY;

CRYSTALLOGRAPHY, X-RAY; MOLECULAR DYNAMICS SIMULATION; MYCOBACTERIUM TUBERCULOSIS; PHOSPHORYLATION; PROTEIN MULTIMERIZATION; PROTEIN STRUCTURE, TERTIARY; PROTEIN-SERINE-THREONINE KINASES;

EID: 84904617793     PISSN: 00062960     EISSN: 15204995     Source Type: Journal    
DOI: 10.1021/bi500245v     Document Type: Article

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