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Ligand · A1BHT

A1BHT · [4-(bromoacetyl)phenoxy]acetic acid

A1BHT, [4-(bromoacetyl)phenoxy]acetic acid (C10 H9 Br O4, 273.1 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry). Every binding site with its residues within 4.5 Å, the residues it binds most and the ligands…

Component
A1BHT
Formula
C10 H9 Br O4
Class
ligand
Structures
1
PDB entries
1

Binding sites

A1BHT in 1 structure; the first of them:

  • 9EEZ · STEP (PTPN5) with active-site disulfide bond and covalent ligand bound to distal C505 and… · A1BHT A601 · binds MET257, ILE283, PRO284, ASN286, HIS312, THR504, CYS505, ARG508 and 1 more

Residues it binds most

GLN 2, CYS 2, PRO 2, ARG 1, ASN 1, GLU 1, HIS 1, ILE 1, LEU 1, MET 1 (residue and the binding sites it lines).

Found with

  • SO4 · Sulfate ion
  • DMS · Dimethyl sulfoxide

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