A quantum chemical study of the mechanism of action of Vitamin K epoxide reductase (VKOR). II. Transition states

Journal of Molecular Graphics and Modelling

Volumn 26, Issue 2, 2007, Pages 401-408

  Davis, Charles H ^a   Deerfield II, David ^b   Wymore, Troy ^b   Stafford, Darrel W ^c   Pedersen, Lee G ^c,d  

^a UNIVERSITY OF NORTH CAROLINA SCHOOL OF MEDICINE   (United States)

^b PITTSBURGH SUPERCOMPUTING CENTER   (United States)

^c UNIVERSITY OF NORTH CAROLINA   (United States)

^d NATIONAL INSTITUTE OF ENVIRONMENTAL HEALTH SCIENCES   (United States)

Author keywords

Mechanisms; Reductase; Transition states; Vitamin K; VKOR

Indexed keywords

DISULFIDE BOND; ENZYMATIC PATHWAY; VITAMIN K; VITAMIN K EPOXIDE REDUCTASE (VKOR);

DATA STRUCTURES; ENZYMES; MAMMALS; PHASE TRANSITIONS; VITAMINS;

QUANTUM CHEMISTRY;

ENZYME; EPOXIDE; QUINONE DERIVATIVE; UNCLASSIFIED DRUG; VITAMIN K EPOXIDE REDUCTASE; VITAMIN K GROUP; WATER;

ARTICLE; CHEMICAL REACTION; CHEMICAL STRUCTURE; DISULFIDE BOND; ENERGY CONSUMPTION; PRIORITY JOURNAL; PROTON TRANSPORT; QUANTUM CHEMISTRY; QUANTUM MECHANICS; THERMODYNAMICS;

EPOXY COMPOUNDS; MIXED FUNCTION OXYGENASES; MODELS, CHEMICAL; MODELS, MOLECULAR; MOLECULAR STRUCTURE; PROTONS; QUANTUM THEORY; THERMODYNAMICS; VITAMIN K; WATER;

MAMMALIA;

EID: 34548227283     PISSN: 10933263     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.jmgm.2006.10.005     Document Type: Article

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