Two states and two more in the mechanisms of hydroxylation and epoxidation by cytochrome P450

Journal of the American Chemical Society

Volumn 127, Issue 37, 2005, Pages 13007-13018

  Hirao, Hajime ^a   Kumar, Devesh ^a   Thiel, Walter ^b   Shaik, Sason ^a  

^a HEBREW UNIVERSITY OF JERUSALEM   (Israel)

^b MAX PLANCK INSTITUT FÜR KOHLENFORSCHUNG   (Germany)

Author keywords

[No Author keywords available]

Indexed keywords

BAND STRUCTURE; ELECTRONS; FREE RADICALS; GROUND STATE; HYDROXYLATION; ION EXCHANGE; OXIDATION;

ELECTRON EXCITATIONS; EPOXIDATION; PENTA-RADICALS; TRIRADICALS;

PIGMENTS;

CARBON; CYTOCHROME P450; HYDROGEN; IRON; LIGAND; PROPYLENE; THIOL DERIVATIVE; THIOLATE DERIVATIVE; UNCLASSIFIED DRUG;

AB INITIO CALCULATION; ARTICLE; CALCULATION; CHEMICAL REACTION; CHEMICAL STRUCTURE; DENSITY FUNCTIONAL THEORY; DYNAMICS; ELECTRON; ENERGY; ENZYME ACTIVITY; ENZYME MECHANISM; EPOXIDATION; HYDROGEN BOND; HYDROXYLATION; MOLECULAR STABILITY; OXIDATION; REACTION ANALYSIS;

ALKENES; CRYSTALLOGRAPHY, X-RAY; CYTOCHROME P-450 ENZYME SYSTEM; EPOXY COMPOUNDS; HYDROGEN BONDING; HYDROXYLATION; KINETICS; MODELS, CHEMICAL; MODELS, MOLECULAR; STEREOISOMERISM;

EID: 25144473534     PISSN: 00027863     EISSN: None     Source Type: Journal    
DOI: 10.1021/ja053847+     Document Type: Article

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