Theoretical Insights into the Reaction and Inhibition Mechanism of Metal-Independent Retaining Glycosyltransferase Responsible for Mycothiol Biosynthesis

Understanding enzymatic reactions with atomic resolution has proven in recent years to be of tremendous interest for biochemical research, and thus, the use of QM/MM methods for the study of reaction mechanisms is experiencing a continuous growth. Glycosyltransferases (GTs) catalyze the formation of...

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Veröffentlicht in:The journal of physical chemistry. B 2017-01, Vol.121 (3), p.471-478
Hauptverfasser: Blanco Capurro, Juan I., Hopkins, Chad W., Pierdominici Sottile, Gustavo, González Lebrero, Mariano C., Roitberg, Adrian E., Marti, Marcelo A.
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Sprache:eng
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