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Ligand · XR3

XR3 · N-[[(3S)-1-oxidanyl-3H-2,1-benzoxaborol-3-yl]methyl]-4-[oxidanyl(oxidanylidene)-$l^{4}-azanyl]benzenesulfonamide

XR3, N-[[(3S)-1-oxidanyl-3H-2,1-benzoxaborol-3-yl]methyl]-4-[oxidanyl(oxidanylidene)-$l^{4}-azanyl]benzenesulfonamide (C14 H13 B N2 O6 S -1, 348.1 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry). Every…

Component
XR3
Formula
C14 H13 B N2 O6 S -1
Class
ligand
Structures
1
PDB entries
1

Binding sites

XR3 in 1 structure; the first of them:

  • 8R30 · Structure of CTX-M-15 complexed with benzoxaborole AK-408 · XR3 A301 · binds CYS69, SER70, LYS73, ASN104, TYR105, SER130, ASN132, GLU166 and 6 more

Residues it binds most

ASN 1, SER 1, THR 1, ARG 1, CYS 1, GLU 1, GLY 1, LYS 1, TYR 1 (residue and the binding sites it lines).

Found with

  • NA · Sodium ion
  • CL · Chloride ion
  • SO4 · Sulfate ion
  • DMS · Dimethyl sulfoxide

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