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Ligand · R19

R19 · Allyl-{6-[3-(4-bromo-phenyl)-benzofuran-6-yloxy]-hexyl-}-methyl-amin

R19, Allyl-{6-[3-(4-bromo-phenyl)-benzofuran-6-yloxy]-hexyl-}-methyl-amin (C24 H28 Br N O2, 442.4 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
R19
Formula
C24 H28 Br N O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

R19 in 2 structures; the first of them:

  • 1O6R · Structures of human oxidosqualene cyclase inhibitors bound to an homologous enzyme · R19 A800 · binds PHE129, TRP169, ALA170, THR173, ILE261, PRO263, ALA306, SER307 and 16 more
  • 1O6R · Structures of human oxidosqualene cyclase inhibitors bound to an homologous enzyme · R19 A800 · binds PHE129, TRP169, ALA170, THR173, ILE261, PRO263, ALA306, SER307 and 16 more

Residues it binds most

PHE 6, TYR 6, ASP 6, TRP 6, ALA 6, ILE 6, LEU 6, PRO 6, SER 6, THR 6 (residue and the binding sites it lines).

Found with

  • C8E · (hydroxyethyloxy)tri(ethyloxy)octane

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