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Ligand · 4AY

4AY · 4-(bromomethyl)benzoic acid

4AY, 4-(bromomethyl)benzoic acid (C8 H7 Br O2, 215.0 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 binds most and the ligands found with…

Component
4AY
Formula
C8 H7 Br O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

4AY in 2 structures; the first of them:

  • 4YD4 · Endothiapepsin in complex with fragment 227 · 4AY A405 · binds LEU13, CYS255, ASP279, GLY281, PRO282, CYS290
  • 4YD4 · Endothiapepsin in complex with fragment 227 · 4AY A405 · binds LEU13, CYS255, ASP279, GLY281, PRO282, CYS290

Residues it binds most

CYS 2, ASP 2, GLY 2, LEU 2, PRO 2 (residue and the binding sites it lines).

Found with

  • BR · Bromide ion
  • DMS · Dimethyl sulfoxide
  • EDO · 1,2-ethanediol
  • GOL · Glycerol
  • PG4 · Tetraethylene glycol

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