Computational Investigation of the Interplay of Substrate Positioning and Reactivity in Catechol O-Methyltransferase

Catechol O-methyltransferase (COMT) is a SAM- and Mg(2+)-dependent methyltransferase that regulates neurotransmitters through methylation. Simulations and experiments have identified divergent catecholamine substrate orientations in the COMT active site: molecular dynamics simulations have favored a...

Descripción completa

Detalles Bibliográficos
Autores principales: Patra, Niladri, Ioannidis, Efthymios I., Kulik, Heather J.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Public Library of Science 2016
Materias:
Research Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5001633/
https://www.ncbi.nlm.nih.gov/pubmed/27564542
http://dx.doi.org/10.1371/journal.pone.0161868

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5001633/
https://www.ncbi.nlm.nih.gov/pubmed/27564542
http://dx.doi.org/10.1371/journal.pone.0161868

Ejemplares similares