DFT/electrostatic calculations of pK a values in cytochrome c oxidase

Journal of Physical Chemistry B

Volumn 109, Issue 8, 2005, Pages 3616-3626

  Popović, Dragan M ^a   Quenneville, Jason ^a   Stuchebrukhov, Alexei A ^a  

^a UNIVERSITY OF CALIFORNIA   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

ELECTROCHEMICAL PROTON GRADIENTS; ELECTRON TRANSPORT; PROTON TRANSFER REACTIONS; PROTONATION;

CHARGED PARTICLES; ELECTROSTATICS; MATHEMATICAL MODELS; PERMITTIVITY; PROBABILITY DENSITY FUNCTION; QUANTUM THEORY; REDOX REACTIONS; REDUCTION;

ENZYME KINETICS;

COPPER; CYTOCHROME C OXIDASE; HISTIDINE; LIGAND; PROTON;

ANIMAL; ARTICLE; CATTLE; CHEMICAL MODEL; CHEMICAL STRUCTURE; CHEMISTRY; COMPUTER PROGRAM; ELECTRICITY; METHODOLOGY; OXIDATION REDUCTION REACTION; PH; PHYSICAL CHEMISTRY; STATIC ELECTRICITY; THERMODYNAMICS;

ANIMALS; CATTLE; CHEMISTRY, PHYSICAL; COPPER; ELECTRON TRANSPORT COMPLEX IV; ELECTROSTATICS; HISTIDINE; HYDROGEN-ION CONCENTRATION; LIGANDS; MODELS, CHEMICAL; MODELS, MOLECULAR; OXIDATION-REDUCTION; PROTONS; SOFTWARE; STATIC ELECTRICITY; THERMODYNAMICS;

EID: 14844358231     PISSN: 15206106     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp046535m     Document Type: Article

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