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Water Complexes of Cytochrome P450: Insights from Energy Decomposition Analysis

Water is a small molecule that nevertheless perturbs, sometimes significantly, the electronic properties of an enzyme’s active site. In this study, interactions of a water molecule with the ferric heme and the compound I (Cpd I) intermediate of cytochrome P450 are studied. Energy decomposition analy...

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Detalles Bibliográficos
Autores principales: Thellamurege, Nandun, Hirao, Hajime
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2013
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6270449/
https://www.ncbi.nlm.nih.gov/pubmed/23752465
http://dx.doi.org/10.3390/molecules18066782