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Discerning the Catalytic Mechanism of Staphylococcus aureus Sortase A with QM/MM Free Energy Calculations

Sortases are key virulence factors in Gram-positive bacteria. These enzymes embed surface proteins in the cell wall through a transpeptidation reaction that involves recognizing a penta-peptide “sorting signal” in a target protein, cleaving it, and covalently attaching it to a second substrate that...

Полное описание

Сохранить в:
Библиографические подробности
Опубликовано в: :J Mol Graph Model
Главные авторы: Shrestha, Pooja, Wereszczynski, Jeff
Формат: Artigo
Язык:Inglês
Опубликовано: 2016
Предметы:
Online-ссылка:https://ncbi.nlm.nih.gov/pmc/articles/PMC4917473/
https://ncbi.nlm.nih.gov/pubmed/27172839
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1016/j.jmgm.2016.04.006
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