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Structure paper

TitleStructural and Mechanistic Insights into NDM-1 Catalyzed Hydrolysis of Cephalosporins.
Journal, issue, pagesJ. Am. Chem. Soc., Vol. 136, Page 14694-14697, Year 2014
Publish dateOct 14, 2014 (structure data deposition date)
AuthorsFeng, H. / Ding, J. / Zhu, D. / Liu, X. / Xu, X. / Zhang, Y. / Zang, S. / Wang, D.C. / Liu, W.
External linksJ. Am. Chem. Soc. / PubMed:25268575
MethodsX-ray diffraction
Resolution1.3 - 2.1 Å
Structure data

PDB-4rl0:
Structural and mechanistic insights into NDM-1 catalyzed hydrolysis of cephalosporins
Method: X-RAY DIFFRACTION / Resolution: 1.3 Å

PDB-4rl2:
Structural and mechanistic insights into NDM-1 catalyzed hydrolysis of cephalosporins
Method: X-RAY DIFFRACTION / Resolution: 2.008 Å

PDB-4rm5:
Structural and mechanistic insights into NDM-1 catalyzed hydrolysis of cephalosporins
Method: X-RAY DIFFRACTION / Resolution: 2.1 Å

Chemicals

ChemComp-ZN:
Unknown entry

ChemComp-3S0:
(2R,5S)-5-[(carbamoyloxy)methyl]-2-[(R)-carboxy{[(2Z)-2-(furan-2-yl)-2-(methoxyimino)acetyl]amino}methyl]-5,6-dihydro-2H-1,3-thiazine-4-carboxylic acid

ChemComp-HOH:
WATER

ChemComp-3S3:
(1R)-2-({(R)-carboxy[(2R,5S)-4-carboxy-5-methyl-5,6-dihydro-2H-1,3-thiazin-2-yl]methyl}amino)-2-oxo-1-phenylethanaminium

Source
  • klebsiella pneumoniae (bacteria)
KeywordsHYDROLASE / NDM-1 antibiotic hydrolysis / hydrolysis of beta-lactam antibiotics

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