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Structure paper

TitleDiscovery of a Cyclic Boronic Acid beta-Lactamase Inhibitor (RPX7009) with Utility vs Class A Serine Carbapenemases.
Journal, issue, pagesJ. Med. Chem., Vol. 58, Page 3682-3692, Year 2015
Publish dateJan 26, 2015 (structure data deposition date)
AuthorsHecker, S.J. / Reddy, K.R. / Totrov, M. / Hirst, G.C. / Lomovskaya, O. / Griffith, D.C. / King, P. / Tsivkovski, R. / Sun, D. / Sabet, M. ...Hecker, S.J. / Reddy, K.R. / Totrov, M. / Hirst, G.C. / Lomovskaya, O. / Griffith, D.C. / King, P. / Tsivkovski, R. / Sun, D. / Sabet, M. / Tarazi, Z. / Clifton, M.C. / Atkins, K. / Raymond, A. / Potts, K.T. / Abendroth, J. / Boyer, S.H. / Loutit, J.S. / Morgan, E.E. / Durso, S. / Dudley, M.N.
External linksJ. Med. Chem. / PubMed:25782055
MethodsX-ray diffraction
Resolution1.5 - 1.75 Å
Structure data

PDB-4xux:
Structure of ampC bound to RPX-7009 at 1.75 A
Method: X-RAY DIFFRACTION / Resolution: 1.75 Å

PDB-4xuz:
Structure of CTX-M-15 bound to RPX-7009 at 1.5 A
Method: X-RAY DIFFRACTION / Resolution: 1.5 Å

Chemicals

ChemComp-4D6:
Vaborbactam / antibiotic, inhibitor*YM

ChemComp-EDO:
1,2-ETHANEDIOL

ChemComp-PG0:
2-(2-METHOXYETHOXY)ETHANOL / inhibitor, precipitant*YM

ChemComp-HOH:
WATER

ChemComp-CL:
Unknown entry

ChemComp-CIT:
CITRIC ACID

Source
  • enterobacter cloacae (bacteria)
  • klebsiella pneumoniae subsp. pneumoniae (bacteria)
KeywordsHydrolase/antibiotic / Hydrolase-antibiotic complex

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