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Ligand · 2BR

2BR · 2-bromophenol

2BR, 2-bromophenol (C6 H5 Br O, 173.0 g/mol), in the MolNFT structures on GenesisL1: bound in 3 records (2 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and the ligands found with it.

Component
2BR
Formula
C6 H5 Br O
Class
ligand
Structures
3
PDB entries
2

Binding sites

2BR in 3 structures; the first of them:

  • 2A9W · E. coli TS complexed with dUMP and inhibitor GA9 · 2BR B1819 · binds CYS50, HIS51, LEU52, ARG53, TYR252
  • 8XJP · Crystal structure of a sulfotransferase S4 in complex with PAP and 2-Phe-br · 2BR A302 · binds VAL21, PHE24, PRO47, MET81, LYS107, HIS109, PHE140, PHE143 and 3 more
  • 2A9W · E. COLI ts complexed with dump and inhibitor GA9 · 2BR B1819 · binds CYS50, HIS51, LEU52, ARG53, TYR252

Residues it binds most

HIS 3, PHE 1, TYR 3, ARG 2, CYS 2, LEU 2, ASN 1, GLU 1, LYS 1, MET 1 (residue and the binding sites it lines).

Found with

  • GA9 · 3,3-bis(3-bromo-4-hydroxyphenyl)-7-chloro-1H,3H-benzo[de]isochromen-1-one
  • UMP · 2'-deoxyuridine 5'-monophosphate
  • PO4 · Phosphate ion
  • BME · Beta-mercaptoethanol
  • GOL · Glycerol
  • A3P · Adenosine-3'-5'-diphosphate

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