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Combined QM/MM Calculations of Active-Site Vibrations in Binding Process of P450cam to Putidaredoxin

Combined QM/MM calculations of the active-site of cytochorme P450cam have been performed before and after the binding of P450cam to putidaredoxin. The calculations were carried out for both a 5-coordinated and a 6-coordinated active-site of cytochrome P450cam, with either a water molecule or a carbo...

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Detalhes bibliográficos
Main Authors: Freindorf, Marek, Shao, Yihan, Kong, Jing, Furlani, Thomas R.
Formato: Artigo
Idioma:Inglês
Publicado em: 2007
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC2292843/
https://ncbi.nlm.nih.gov/pubmed/18180042
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1016/j.jinorgbio.2007.11.006
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