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Ligand · XCB

XCB · 7-[(1~{S})-1-[4-(aminomethyl)phenyl]carbonyloxyethyl]-3-[3-chloranyl-4-(methylsulfonylmethyl)phenyl]-1~{H}-indole-2-carboxylic acid

XCB, 7-[(1~{S})-1-[4-(aminomethyl)phenyl]carbonyloxyethyl]-3-[3-chloranyl-4-(methylsulfonylmethyl)phenyl]-1~{H}-indole-2-carboxylic acid (C27 H25 Cl N2 O6 S, 541.0 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB…

Component
XCB
Formula
C27 H25 Cl N2 O6 S
Class
ligand
Structures
1
PDB entries
1

Binding sites

XCB in 1 structure; the first of them:

  • 8P9S · Crystal structure of the metallo-beta-lactamase VIM1 with 2482 · XCB A303 · binds PHE62, TYR67, TRP87, HIS116, ASP117, ASP118, GLU146, HIS179 and 11 more

Residues it binds most

HIS 1, ASP 1, ALA 1, SER 1, ASN 1, CYS 1, GLU 1, GLY 1, PHE 1, THR 1 (residue and the binding sites it lines).

Found with

  • ZN · Zinc ion
  • DMS · Dimethyl sulfoxide

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