Theoretical and experimental determination on two substrates turned over by 4-oxalocrotonate tautomerase

Journal of Physical Chemistry A

Volumn 110, Issue 2, 2006, Pages 700-708

  Andres Cisneros G ^a,b   Wang, Min ^a   Silinski, Peter ^a   Fitzgerald, Michael C ^a   Yang, Weitao ^a  

^a DUKE UNIVERSITY   (United States)

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

Author keywords

[No Author keywords available]

Indexed keywords

4-OXALOCROTONATE TAUTOMERASE (4OT); MOLECULAR MECHANICAL (MM) CALCULATIONS;

CARBON; CATALYSIS; FREE ENERGY; MOLECULAR DYNAMICS; OXYGEN; QUANTUM THEORY; REACTION KINETICS;

ENZYMES;

2 HYDROXYMUCONIC ACID; 2-HYDROXYMUCONIC ACID; 4 OXALOCROTONATE TAUTOMERASE; 4-OXALOCROTONATE TAUTOMERASE; DRUG DERIVATIVE; ISOMERASE; PROTON; SORBIC ACID;

ARTICLE; CHEMICAL STRUCTURE; ENZYME SPECIFICITY; KINETICS; METABOLISM; THEORETICAL MODEL;

ISOMERASES; KINETICS; MODELS, MOLECULAR; MODELS, THEORETICAL; PROTONS; SORBIC ACID; SUBSTRATE SPECIFICITY;

EID: 31544451535     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp0543328     Document Type: Article

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