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Ligand · BVB

BVB · 5-[(E)-2-(4-bromophenyl)ethenyl]benzene-1,3-diol

BVB, 5-[(E)-2-(4-bromophenyl)ethenyl]benzene-1,3-diol (C14 H11 Br O2, 291.1 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most…

Component
BVB
Formula
C14 H11 Br O2
Class
ligand
Structures
4
PDB entries
2

Binding sites

BVB in 4 structures; the first of them:

  • 4C78 · Complex of human Sirt3 with Bromo-Resveratrol and ACS2 peptide · BVB A1395 · binds ARG139, PRO310, MET311, ALA312, ASP313, ARG335
  • 4C7B · Complex of human Sirt3 with Bromo-Resveratrol and Fluor-De-Lys peptide · BVB A1395 · binds GLY145, ALA146, SER149, ILE154, PHE157, ARG158, LEU173, PRO176 and 7 more
  • 4C78 · Complex of human SIRT3 with bromo-resveratrol and ACS2 peptide · BVB A1395 · binds ARG139, PRO310, MET311, ALA312, ASP313, ARG335
  • 4C7B · Complex of human SIRT3 with bromo-resveratrol and fluor-de-lys peptide · BVB A1395 · binds GLY145, ALA146, SER149, ILE154, PHE157, ARG158, LEU173, PRO176 and 7 more

Residues it binds most

ARG 4, ILE 2, ALA 4, ASP 4, LEU 2, PHE 2, PRO 4, ASN 2, GLN 2, GLY 2 (residue and the binding sites it lines).

Found with

  • ZN · Zinc ion
  • GOL · Glycerol
  • IPA · Isopropyl alcohol

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