Broken Symmetry DFT Calculations/Analysis for Oxidized and Reduced Dinuclear Center in Cytochrome c Oxidase: Relating Structures, Protonation States, Energies, and Mössbauer Properties in ba(3)Thermus thermophilus

[Image: see text] The Fe(a3)(3+)···Cu(B)(2+) dinuclear center (DNC) structure of the as-isolated oxidized ba(3) cytochrome c oxidase (CcO) from Thermus thermophilus (Tt) is still not fully understood. When the proteins are initially crystallized in the oxidized state, they typically become radiolyti...

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Detalles Bibliográficos
Autores principales: Han Du, Wen-Ge, Noodleman, Louis
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2015
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4525772/
https://www.ncbi.nlm.nih.gov/pubmed/26192749
http://dx.doi.org/10.1021/acs.inorgchem.5b00700

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4525772/
https://www.ncbi.nlm.nih.gov/pubmed/26192749
http://dx.doi.org/10.1021/acs.inorgchem.5b00700

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