QM/MM simulations identify the determinants of catalytic activity differences between type II dehydroquinase enzymes

Org. Biomol. Chem., 2018, Advance ArticleDOI: 10.1039/C8OB00066B, Paper Open Access &nbsp This article is licensed under a Creative Commons Attribution 3.0 Unported Licence.Emilio Lence, Marc W. van der Kamp, Concepcion Gonzalez-Bello, Adrian J. MulhollandMultiscale simulations pinpoint specific interactions responsible for differences in stabilization of key reacting species in two recognized targets for antibiotic development.To cite this article before page numbers are assigned, use the DOI form of citation above.The content of this RSS Feed (c) The Royal Society of Chemistry

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