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Ligand · CE3

CE3 · (6R,7R)-3-(acetyloxymethyl)-7-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-methoxyimino-ethanoyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

CE3, (6R,7R)-3-(acetyloxymethyl)-7-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-methoxyimino-ethanoyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (C16 H17 N5 O7 S2, 455.5 g/mol), in the MolNFT structures on GenesisL1: bound…

Component
CE3
Formula
C16 H17 N5 O7 S2
Class
ligand
Structures
4
PDB entries
2

Binding sites

CE3 in 4 structures; the first of them:

  • 5NZY · Crystal structure of DNA cross-link repair protein 1A in complex with Cefotaxime · CE3 A1102 · binds ILE937, ASN938, PHE939, ARG960, THR962, GLN979, ILE986, TYR987 and 1 more
  • 6C79 · Conformational Changes in a Class A Beta lactamase that Prime it for Catalysis · CE3 A301 · binds CYS69, ALA70, LYS73, ASN104, TYR105, SER130, ASN132, PRO167 and 9 more
  • 5NZY · Crystal structure of DNA cross-link repair protein 1A in complex with cefotaxime · CE3 A1102 · binds ILE937, ASN938, PHE939, ARG960, THR962, GLN979, ILE986, GLY988
  • 6C79 · Conformational changes in a class a beta lactamase that prime it for catalysis · CE3 A301 · binds CYS69, ALA70, ASN104, TYR105, SER130, ASN132, PRO167, ASN170 and 8 more

Residues it binds most

ASN 6, THR 6, GLY 6, TYR 5, ARG 4, ASP 4, GLN 4, ILE 2, PHE 4, PRO 4 (residue and the binding sites it lines).

Found with

  • NI · Nickel (II) ion
  • SO4 · Sulfate ion

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