Linking Chemical Electron–Proton Transfer to Proton Pumping in Cytochrome c Oxidase: Broken-Symmetry DFT Exploration of Intermediates along the Catalytic Reaction Pathway of the Iron–Copper Dinuclear Complex

[Image: see text] After a summary of the problem of coupling electron and proton transfer to proton pumping in cytochrome c oxidase, we present the results of our earlier and recent density functional theory calculations for the dinuclear Fe-a(3)–Cu(B) reaction center in this enzyme. A specific cata...

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Detalles Bibliográficos
Autores principales: Noodleman, Louis, Han Du, Wen-Ge, Fee, James A., Götz, Andreas W., Walker, Ross C.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2014
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4095914/
https://www.ncbi.nlm.nih.gov/pubmed/24960612
http://dx.doi.org/10.1021/ic500363h

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4095914/
https://www.ncbi.nlm.nih.gov/pubmed/24960612
http://dx.doi.org/10.1021/ic500363h

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