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Ligand · Y0B

Y0B · 2-methoxy-6-{[(1-propyl-1H-benzimidazol-2-yl)amino]methyl}phenol

Y0B, 2-methoxy-6-{[(1-propyl-1H-benzimidazol-2-yl)amino]methyl}phenol (C18 H21 N3 O2, 311.4 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry). Every binding site with its residues within 4.5 Å, the residues it…

Component
Y0B
Formula
C18 H21 N3 O2
Class
ligand
Structures
1
PDB entries
1

Binding sites

Y0B in 1 structure; the first of them:

  • 8T0N · Structure of Compound 4 bound to human ALDH1A1 · Y0B A603 · binds SER121, ASP122, GLY125, THR129, PHE171, VAL174, MET175, TRP178 and 10 more

Residues it binds most

CYS 1, GLY 1, PHE 1, SER 1, VAL 1, ALA 1, ASP 1, ILE 1, LEU 1, MET 1 (residue and the binding sites it lines).

Found with

  • NAD · Nicotinamide-adenine-dinucleotide
  • YB · Ytterbium (III) ion
  • CL · Chloride ion

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