Metalloion-ligand binding energies and biological function of metalloenzymes such as carbonic anhydrase. A study based on ab initio calculations and experimental ion-ligand equilibria in the gas phase

Journal of the American Chemical Society

Volumn 122, Issue 7, 2000, Pages 1492-1505

  Peschke, Michael ^a   Blades, Arthur T ^a   Kebarle, Paul ^a  

^a UNIVERSITY OF ALBERTA   (Canada)

Author keywords

[No Author keywords available]

Indexed keywords

AMINO ACID; CARBONATE DEHYDRATASE; HISTIDINE; IMIDAZOLE; LIGAND; METAL ION; METALLOPROTEIN; WATER; ZINC;

AQUEOUS SOLUTION; ARTICLE; BINDING AFFINITY; CALCULATION; CHEMICAL BOND; CHEMICAL STRUCTURE; ENERGY; ENZYME ACTIVE SITE; ENZYME ACTIVITY; GAS; HYDRATION; LIGAND BINDING; POLARIZATION; SOLVATION;

EID: 0034002048     PISSN: 00027863     EISSN: None     Source Type: Journal    
DOI: 10.1021/ja992406l     Document Type: Article

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