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TitleIdentification of the Inhibitory Compounds for Metallo-beta-lactamases and Structural Analysis of the Binding Modes.
Journal, issue, pagesChem Pharm Bull (Tokyo), Vol. 69, Page 1179-1183, Year 2021
Publish dateFeb 28, 2019 (structure data deposition date)
AuthorsKamo, T. / Kuroda, K. / Kondo, S. / Hayashi, U. / Fudo, S. / Yoneda, T. / Takaya, A. / Nukaga, M. / Hoshino, T.
External linksChem Pharm Bull (Tokyo) / PubMed:34853284
MethodsX-ray diffraction
Resolution2.006 - 2.444 Å
Structure data

PDB-6jka:
Crystal structure of metallo-beta-lactamse, IMP-1, in complex with a thiazole-bearing inhibitor
Method: X-RAY DIFFRACTION / Resolution: 2.006 Å

PDB-6jkb:
Crystal structure of metallo-beta-lactamse, NDM-1, in complex with hydrolyzed ampicillin
Method: X-RAY DIFFRACTION / Resolution: 2.444 Å

Chemicals

ChemComp-ZN:
Unknown entry

ChemComp-BS0:
6-[2-(phenoxymethyl)-1,3-thiazol-4-yl]-3,4-dihydro-1H-quinolin-2-one

ChemComp-BQU:
3-[2-azanyl-5-[2-(phenoxymethyl)-1,3-thiazol-4-yl]phenyl]propanoic acid

ChemComp-HOH:
WATER

ChemComp-ZZ7:
(2R,4S)-2-[(R)-{[(2R)-2-amino-2-phenylacetyl]amino}(carboxy)methyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid

Source
  • serratia marcescens (bacteria)
  • klebsiella pneumoniae (bacteria)
KeywordsHYDROLASE / ANTIBIOTIC

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