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Rational design and synthesis of substrate-product analogue inhibitors of α-methylacyl-coenzyme A racemase from Mycobacterium tuberculosis. | LitMetric
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Rational design and synthesis of substrate-product analogue inhibitors of α-methylacyl-coenzyme A racemase from Mycobacterium tuberculosis.

Mohan Pal Mandar Khanal Ryan Marko Srinath Thirumalairajan Stephen L Bearne

Chem Commun (Camb)

Department of Biochemistry & Molecular Biology, Dalhousie University, Halifax, NS B3H 4R2, Canada. and Department of Chemistry, Dalhousie University, Halifax, NS B3H 4R2, Canada.

Published: February 2016

2,2-Bis(4-isobutylphenyl)propanoyl-CoA and 2,2-bis(4-t-butylphenyl)propanoyl-CoA are rationally designed, gem-disubstituted substrate-product analogues that competitively inhibit α-methylacyl-coenzyme A racemase from Mycobacterium tuberculosis with Ki values of 16.9 ± 0.6 and 21 ± 4 μM, respectively, exceeding the enzyme's affinity for the substrate by approximately 5-fold.

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 Source
http://dx.doi.org/10.1039/c5cc08096gDOI Listing

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