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Ligand · BBI

BBI · (2-butyl-1-benzofuran-3-yl){4-[2-(diethylamino)ethoxy]-3,5-diiodophenyl}methanone

BBI, (2-butyl-1-benzofuran-3-yl){4-[2-(diethylamino)ethoxy]-3,5-diiodophenyl}methanone (C25 H29 I2 N O3, 645.3 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry). Every binding site with its residues within 4.5…

Component
BBI
Formula
C25 H29 I2 N O3
Class
ligand
Structures
1
PDB entries
1

Binding sites

BBI in 1 structure; the first of them:

  • 5H4D · Crystal structure of hSIRT3 in complex with a specific agonist Amiodarone hydrochloride · BBI A403 · binds PHE157, ARG158, GLU177, PHE294, GLU323, VAL324

Residues it binds most

GLU 2, PHE 2, ARG 2, VAL 2, ALY 1 (residue and the binding sites it lines).

Found with

  • MCM · 7-amino-4-methyl-chromen-2-one
  • NAD · Nicotinamide-adenine-dinucleotide
  • MG · Magnesium ion
  • ZN · Zinc ion
  • PEG · Di(hydroxyethyl)ether

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