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Ligand · BB3

BB3 · 3-(3,5-dibromo-4-hydroxy-benzoyl)-2-ethyl-benzofuran-6-sulfonic acid dimethylamide

BB3, 3-(3,5-dibromo-4-hydroxy-benzoyl)-2-ethyl-benzofuran-6-sulfonic acid dimethylamide (C19 H17 Br2 N O5 S, 531.2 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within…

Component
BB3
Formula
C19 H17 Br2 N O5 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

BB3 in 2 structures; the first of them:

  • 1T48 · Allosteric Inhibition of Protein Tyrosine Phosphatase 1B · BB3 A299 · binds ALA189, LEU192, ASN193, PHE196, GLU200, GLU276, GLY277, PHE280 and 3 more
  • 1T48 · Allosteric inhibition of protein tyrosine phosphatase 1B · BB3 A299 · binds ALA189, LEU192, ASN193, PHE196, GLU200, GLU276, GLY277, PHE280 and 3 more

Residues it binds most

GLU 2, PHE 2, ALA 2, ASN 2, GLY 2, ILE 2, LEU 2, LYS 2, TRP 2 (residue and the binding sites it lines).

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