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Insights on the origin of catalysis on glycine N-methyltransferase from computational modelling

The origin of enzyme catalysis remains a question of debate despite much intense study. We report a QM/MM theoretical study of the S(N)2 methyl transfer reaction catalyzed by a glycine N-methyltransferase (GNMT) and three mutants to test whether recent experimental observations of rate-constant redu...

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Detalhes bibliográficos
Publicado no:J Am Chem Soc
Main Authors: Świderek, Katarzyna, Tuñón, Iñaki, Williams, Ian H., Moliner, Vicent
Formato: Artigo
Idioma:Inglês
Publicado em: 2018
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC6613375/
https://ncbi.nlm.nih.gov/pubmed/29460630
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/jacs.7b13655
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