A Theoretical Study of the Dynamic Behavior of Alkane Hydroxylation by a Compound I Model of Cytochrome P450

2001 ◽  
Vol 123 (40) ◽  
pp. 9806-9816 ◽  
Author(s):  
Kazunari Yoshizawa ◽  
Takashi Kamachi ◽  
Yoshihito Shiota
Keyword(s):  
Cytochrome P450 ◽  
Dynamic Behavior ◽  
Theoretical Study ◽  
Compound I ◽  
Alkane Hydroxylation

Theoretical Study on Compound I Formation in Monooxygenation Mechanism by Cytochrome P450

2004 ◽  
Vol 108 (30) ◽  
pp. 11189-11195 ◽  
Author(s):  
Masayuki Hata ◽  
Yoshinori Hirano ◽  
Tyuji Hoshino ◽  
Rie Nishida ◽  
Minoru Tsuda
Keyword(s):  
Cytochrome P450 ◽  
Theoretical Study ◽  
Compound I

New Features in the Catalytic Cycle of Cytochrome P450 during the Formation of Compound I from Compound 0

2005 ◽  
Vol 109 (42) ◽  
pp. 19946-19951 ◽  
Author(s):  
Devesh Kumar ◽  
Hajime Hirao ◽  
Sam P. de Visser ◽  
Jingjing Zheng ◽  
Dongqi Wang ◽  
...  
Keyword(s):  
Cytochrome P450 ◽  
Catalytic Cycle ◽  
Compound I

ChemInform Abstract: CYTOCHROME P450 MEDIATED AROMATIC OXIDATION: A THEORETICAL STUDY

1985 ◽  
Vol 16 (44) ◽  
Author(s):  
K. KORZEKWA ◽  
W. TRAGER ◽  
M. GOUTERMAN ◽  
D. SPANGLER ◽  
G. H. LOEW
Keyword(s):  
Cytochrome P450 ◽  
Theoretical Study

A theoretical study on the oxidative metabolism of 4-chloroacetanilide by cytochrome P450: Alternative mechanisms for migration of 4-substituents during enzymatic oxidation

2010 ◽  
Vol 112 (2) ◽  
pp. 186-190 ◽  
Author(s):  
L. M. H. Koymans ◽  
W. M. P. B. Menge ◽  
G. M. Donné-Op Den Kelder ◽  
J. M. Te Koppele ◽  
N. P. E. Vermeulen ◽  
...  
Keyword(s):  
Cytochrome P450 ◽  
Oxidative Metabolism ◽  
Theoretical Study ◽  
Enzymatic Oxidation
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