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Ligand · H9O

H9O · 2-[(3R)-1-oxidanyl-3H-2,1-benzoxaborol-3-yl]prop-2-enoic acid

H9O, 2-[(3R)-1-oxidanyl-3H-2,1-benzoxaborol-3-yl]prop-2-enoic acid (C10 H9 B O4, 204.0 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5 Å, the residues it…

Component
H9O
Formula
C10 H9 B O4
Class
ligand
Structures
2
PDB entries
1

Binding sites

H9O in 2 structures; the first of them:

  • 7DML · OXA-48 carbapenemase in complex with (R)-2-(1-hydroxy-1,3-dihydrobenzo[c][1,2]oxaborol-3-y… · H9O A301 · binds ALA69, SER70, KCX73, ILE102, TRP105, TYR117, SER118, VAL120 and 6 more
  • 7DML · Oxa-48 carbapenemase in complex with (R)-2-(1-hydroxy-1,3… · H9O A301 · binds ALA69, SER70, KCX73, ILE102, TRP105, SER118, VAL120, THR209 and 3 more

Residues it binds most

SER 8, TYR 8, ALA 8, ARG 8, GLY 8, ILE 8, KCX 8, THR 8, TRP 8, VAL 8 (residue and the binding sites it lines).

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