A predictive pattern of computed barriers for C-H hydroxylation by compound I of cytochrome P450

Journal of the American Chemical Society

Volumn 126, Issue 27, 2004, Pages 8362-8363

  De Visser, Sam P ^a   Kumar, Devesh ^a   Cohen, Shimrit ^a   Shacham, Ronen ^a   Shaik, Sason ^a  

^a HEBREW UNIVERSITY OF JERUSALEM   (Israel)

Author keywords

[No Author keywords available]

Indexed keywords

CARBON; CYTOCHROME P450; HYDROGEN;

ARTICLE; CHEMICAL STRUCTURE; DENSITY FUNCTIONAL THEORY; ENERGY; ENZYME ACTIVITY; ENZYME SUBSTRATE; HYDROXYLATION;

ALKANES; BENZENE DERIVATIVES; CAMPHOR 5-MONOOXYGENASE; CYTOCHROME P-450 ENZYME SYSTEM; FERRIC COMPOUNDS; HYDROGEN; HYDROXYLATION; IRON COMPOUNDS; PHENOLS; THERMODYNAMICS;

EID: 3142730759     PISSN: 00027863     EISSN: None     Source Type: Journal    
DOI: 10.1021/ja048528h     Document Type: Article

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