Water-based hydrogen-atom wires as mediators in long-range proton-coupled electron transfer in enzymes: A new twist on water reactivity

Chemistry - A European Journal

Volumn 17, Issue 30, 2011, Pages 8318-8323

  Cárdenas, Diego J ^a   Cuerva, Juan M ^b   Alías, Miriam ^c   Buñuel, Elena ^a   Campaña, Araceli G ^a  

^a UNIVERSIDAD AUTÓNOMA DE MADRID   (Spain)

^b UNIVERSITY OF GRANADA   (Spain)

^c UNIVERSITY OF ZARAGOZA   (Spain)

Author keywords

density functional calculations; hydrogen transfer; metalloenzymes; molecular dynamics; water

Indexed keywords

ATOMS; COPPER COMPOUNDS; DENSITY FUNCTIONAL THEORY; ELECTRON TRANSITIONS; HYDROGEN; METAL COMPLEXES; MOLECULAR DYNAMICS; WATER;

ATOM EXCHANGE; CU COMPLEXES; HYDROGEN ATOMS; HYDROGEN TRANSFER; LONG-RANGE ELECTRON TRANSFER; METALLOENZYMES; MONOOXYGENASES; PROTON COUPLED ELECTRON TRANSFERS;

ENZYMES;

EID: 79960331344     PISSN: 09476539     EISSN: 15213765     Source Type: Journal    
DOI: 10.1002/chem.201100964     Document Type: Article

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