The reaction mechanism of cytochrome P450 NO reductase: A detailed quantum mechanics/molecular mechanics study

ChemPhysChem

Volumn 12, Issue 17, 2011, Pages 3192-3203

  Riplinger, Christoph ^a   Neese, Frank ^a  

^a MAX PLANCK INSTITUTE FOR CHEMICAL ENERGY CONVERSION   (Germany)

Author keywords

enzymes; hydride transfer; kinetic isotope effect; kinetics; QM MM calculations

Indexed keywords

ENZYME KINETICS; ENZYMES; HYDRIDES; HYDROGEN BONDS; ISOTOPES; KINETICS; MOLECULAR MODELING; QUANTUM THEORY; REACTION INTERMEDIATES;

ACTIVATION BARRIERS; HYDRIDE ION TRANSFER; HYDRIDE TRANSFERS; KINETIC AND THERMODYNAMIC PROPERTIES; KINETIC ISOTOPE EFFECTS; QM/MM CALCULATIONS; QUANTUM MECHANICS/MOLECULAR MECHANICS; REACTION MECHANISM;

REDUCTION;

EID: 82955229567     PISSN: 14394235     EISSN: 14397641     Source Type: Journal    
DOI: 10.1002/cphc.201100523     Document Type: Article

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