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Ligand · BDE

BDE · N'-[(1E)-(3,5-dibromo-2,4-dihydroxyphenyl)methylene]nicotinohydrazide

BDE, N'-[(1E)-(3,5-dibromo-2,4-dihydroxyphenyl)methylene]nicotinohydrazide (C13 H9 Br2 N3 O3, 415.0 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5 Å, the…

Component
BDE
Formula
C13 H9 Br2 N3 O3
Class
ligand
Structures
2
PDB entries
1

Binding sites

BDE in 2 structures; the first of them:

  • 2GLP · Crystal structure of (3R)-Hydroxyacyl-Acyl Carrier Protein Dehydratase(FabZ) from… · BDE A3001 · binds PHE59, LYS62, ILE64, PHE109, ILE111, PRO112, PRO22, ILE98 and 3 more
  • 2GLP · Crystal structure of (3R)-hydroxyacyl-acyl carrier protein DEHYDRATASE(FABZ) from… · BDE A3001 · binds PHE59, LYS62, ILE64, PHE109, ILE111, PRO112, PRO22, ILE98 and 3 more

Residues it binds most

ILE 4, PHE 4, LYS 4, PRO 4, ARG 4, TYR 4, ALA 2, GLU 2, GLY 2, HIS 2 (residue and the binding sites it lines).

Found with

  • BEN · Benzamidine
  • CL · Chloride ion

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