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Ligand · 4BB

4BB · 4-tert-butyl-N'-[(1E)-(3,5-dibromo-2,4-dihydroxyphenyl)methylidene]benzohydrazide

4BB, 4-tert-butyl-N'-[(1E)-(3,5-dibromo-2,4-dihydroxyphenyl)methylidene]benzohydrazide (C18 H18 Br2 N2 O3, 470.2 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within…

Component
4BB
Formula
C18 H18 Br2 N2 O3
Class
ligand
Structures
2
PDB entries
1

Binding sites

4BB in 2 structures; the first of them:

  • 3DP3 · Crystal structure of (3R)-Hydroxyacyl-Acyl Carrier Protein Dehydratase (FabZ) from… · 4BB A163 · binds PHE59, LYS62, ILE64, PHE109, ARG110, ILE111, PRO112, PRO22 and 4 more
  • 3DP3 · Crystal structure of (3R)-hydroxyacyl-acyl carrier protein dehydratase (fabz) from… · 4BB A163 · binds PHE59, LYS62, ILE64, PHE109, ARG110, ILE111, PRO112, PRO22 and 4 more

Residues it binds most

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

Found with

  • BEN · Benzamidine
  • CL · Chloride ion

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