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TitleDiscovery of an Orally Available Diazabicyclooctane Inhibitor (ETX0282) of Class A, C, and D Serine beta-Lactamases.
Journal, issue, pagesJ. Med. Chem., Vol. 63, Page 12511-12525, Year 2020
Publish dateJan 10, 2020 (structure data deposition date)
AuthorsDurand-Reville, T.F. / Comita-Prevoir, J. / Zhang, J. / Wu, X. / May-Dracka, T.L. / Romero, J.A.C. / Wu, F. / Chen, A. / Shapiro, A.B. / Carter, N.M. ...Durand-Reville, T.F. / Comita-Prevoir, J. / Zhang, J. / Wu, X. / May-Dracka, T.L. / Romero, J.A.C. / Wu, F. / Chen, A. / Shapiro, A.B. / Carter, N.M. / McLeod, S.M. / Giacobbe, R.A. / Verheijen, J.C. / Lahiri, S.D. / Sacco, M.D. / Chen, Y. / O'Donnell, J.P. / Miller, A.A. / Mueller, J.P. / Tommasi, R.A.
External linksJ. Med. Chem. / PubMed:32658473
MethodsX-ray diffraction
Resolution1.28 Å
Structure data

PDB-6vhs:
Crystal structure of CTX-M-14 in complex with beta-lactamase inhibitor ETX1317
Method: X-RAY DIFFRACTION / Resolution: 1.28 Å

Chemicals

ChemComp-X57:
(2R)-({[(3R,6S)-6-carbamoyl-1-formyl-4-methyl-1,2,3,6-tetrahydropyridin-3-yl]amino}oxy)(fluoro)acetic acid

ChemComp-PO4:
PHOSPHATE ION

ChemComp-HOH:
WATER

Source
  • escherichia coli (E. coli)
KeywordsHYDROLASE / CTX-M-14 / beta-lactamase / b-lactamase / etx3517 / etx-3517 / avibactam / dbo

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