Ab initio MO study on the catalytic mechanism in the active site of carbonic anhydrase

Journal of Molecular Structure: THEOCHEM

Volumn 461-462, Issue , 1999, Pages 439-452

  Muguruma, Chizuru ^a  

^a NATL INST OF MAT AND CHEM RES   (Japan)

Author keywords

Ab initio molecular orbital method; Active site model of carbonic anhydrase; Catalytic mechanism; Hydration of carbon dioxide; Uncatalyzed reaction

Indexed keywords

CARBONATE DEHYDRATASE; ZINC COMPLEX;

ARTICLE; CATALYSIS; CHEMICAL BOND; COMPLEX FORMATION; ENZYME ACTIVE SITE; ISOMERISM; MOLECULAR MODEL; PROTON TRANSPORT; REACTION ANALYSIS;

EID: 0004914140     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0166-1280(98)00455-2     Document Type: Article

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