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TitleDiscovery of a Cyclic Choline Analog That Inhibits Anaerobic Choline Metabolism by Human Gut Bacteria.
Journal, issue, pagesAcs Med. Chem. Lett., Vol. 11, Page 1980-1985, Year 2020
Publish dateFeb 15, 2020 (structure data deposition date)
AuthorsBollenbach, M. / Ortega, M. / Orman, M. / Drennan, C.L. / Balskus, E.P.
External linksAcs Med. Chem. Lett. / PubMed:33062182
MethodsX-ray diffraction
Resolution2.28 Å
Structure data

PDB-6vue:
wild-type choline TMA lyase in complex with 1-methyl-1,2,3,6-tetrahydropyridin-3-ol
Method: X-RAY DIFFRACTION / Resolution: 2.28 Å

Chemicals

ChemComp-NA:
Unknown entry

ChemComp-RP7:
(3S)-1-methyl-1,2,3,6-tetrahydropyridin-3-ol

ChemComp-HOH:
WATER

Source
  • desulfovibrio alaskensis (strain g20) (bacteria)
KeywordsLYASE/INHIBITOR / Choline-TMA Lyase / Microbiome choline CutC inhibitor / LYASE / LYASE-INHIBITOR complex

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