Role of protein frame and solvent for the redox properties of azurin from Pseudomonas aeruginosa

Proceedings of the National Academy of Sciences of the United States of America

Volumn 103, Issue 52, 2006, Pages 19641-19646

  Cascella, Michele ^a   Magistrato, Alessandra ^b   Tavernelli, Ivano ^a   Carloni, Paolo ^b   Rothlisberger, Ursula ^a  

^a EPFL   (Switzerland)

^b SISSA   (Italy)

Author keywords

Density functional theory; Electron transfer; Molecular dynamics; Reorganization energy

Indexed keywords

AZURIN; COPPER; SOLVENT; WATER;

ARTICLE; BINDING SITE; CHEMICAL STRUCTURE; DENSITY FUNCTIONAL THEORY; ELECTRICITY; ELECTRON TRANSPORT; ENERGY; MOLECULAR DYNAMICS; NONHUMAN; OXIDATION REDUCTION POTENTIAL; PRIORITY JOURNAL; PROTEIN FUNCTION; PROTEIN STRUCTURE; PSEUDOMONAS AERUGINOSA; QUANTITATIVE ANALYSIS; QUANTUM MECHANICS;

AZURIN; BINDING SITES; COMPUTATIONAL BIOLOGY; COMPUTER SIMULATION; COPPER; ELECTROSTATICS; MODELS, MOLECULAR; OXIDATION-REDUCTION; PROTEIN STRUCTURE, TERTIARY; PSEUDOMONAS AERUGINOSA; SOLVENTS;

PSEUDOMONAS AERUGINOSA;

EID: 33845935792     PISSN: 00278424     EISSN: None     Source Type: Journal    
DOI: 10.1073/pnas.0607890103     Document Type: Article

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