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Carbinolamine Formation and Dehydration in a DNA Repair Enzyme Active Site

In order to suggest detailed mechanistic hypotheses for the formation and dehydration of a key carbinolamine intermediate in the T4 pyrimidine dimer glycosylase (T4PDG) reaction, we have investigated these reactions using steered molecular dynamics with a coupled quantum mechanics–molecular mechanic...

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Detalles Bibliográficos
Autores principales:	Dodson, M. L., Walker, Ross C., Lloyd, R. Stephen
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	Public Library of Science 2012
Materias:	Research Article
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3285167/ https://www.ncbi.nlm.nih.gov/pubmed/22384015 http://dx.doi.org/10.1371/journal.pone.0031377

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