Journal
CHEMICAL COMMUNICATIONS
Volume 57, Issue 40, Pages 4934-4937Publisher
ROYAL SOC CHEMISTRY
DOI: 10.1039/d1cc01231b
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Funding
- National Institutes of Health [R21 AI138934, R01 AI149444]
- Natural Sciences and Engineering and Research Council of Canada Postdoctoral Fellowship
- Department of Defense National Defense Science and Engineering Graduate Fellowship
- Achievement Rewards for College Scientists Foundation fellowship
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This study demonstrates the screening of metal-binding pharmacophores against a zinc-dependent metalloenzyme using F-19 NMR, showing the potential of F-19 NMR-based techniques for ligand discovery in metalloenzymes.
This study demonstrates the screening of a collection of twelve F-19-tagged metal-binding pharmacophores (MBPs) against the Zn(ii)-dependent metalloenzyme human carbonic anhydrase II (hCAII) by F-19 NMR. The isomorphous replacement of Zn(ii) by Co(ii) in hCAII produces enhanced sensitivity and reveals the potential of F-19 NMR-based techniques for metalloenzyme ligand discovery.
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