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Ligand · VA1

VA1 · {5-[(diformylamino)methyl]-1-benzothien-2-yl}boronic acid

VA1, {5-[(diformylamino)methyl]-1-benzothien-2-yl}boronic acid (C11 H10 B N O4 S, 263.1 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
VA1
Formula
C11 H10 B N O4 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

VA1 in 2 structures; the first of them:

  • 2I72 · AmpC beta-lactamase in complex with 5-diformylaminomethyl-benzo[b]thiophen-2-boronic acid · VA1 A964 · binds GLY63, SER64, LYS67, LEU119, GLN120, VAL121, ASP123, TYR150 and 5 more
  • 2I72 · Ampc beta-lactamase in complex with 5-diformylaminomethyl- BENZO[B]THIOPHEN-2-boronic acid · VA1 A964 · binds GLY63, SER64, LYS67, LEU119, GLN120, VAL121, ASP123, TYR150 and 5 more

Residues it binds most

GLY 4, TYR 4, LYS 4, ALA 4, ASN 4, ASP 4, GLN 4, LEU 4, SER 4, VAL 4 (residue and the binding sites it lines).

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