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

Type II dehydroquinase enzymes (DHQ2), recognized targets for antibiotic drug discovery, show significantly different activities dependent on the species: DHQ2 from Mycobacterium tuberculosis (MtDHQ2) and Helicobacter pylori (HpDHQ2) show a 50-fold difference in catalytic efficiency. Revealing the d...

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Publicat a:Org Biomol Chem
Autors principals: Lence, Emilio, van der Kamp, Marc W., González-Bello, Concepción, Mulholland, Adrian J.
Format: Artigo
Idioma:Inglês
Publicat: Royal Society of Chemistry 2018
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Accés en línia:https://ncbi.nlm.nih.gov/pmc/articles/PMC6011038/
https://ncbi.nlm.nih.gov/pubmed/29767194
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1039/c8ob00066b
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