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Ligand · YAB

YAB · (8R)-3-(4-chlorophenyl)-5-methyl-N-{[(2S)-oxolan-2-yl]methyl}pyrazolo[1,5-a]pyrimidin-7-amine

YAB, (8R)-3-(4-chlorophenyl)-5-methyl-N-{[(2S)-oxolan-2-yl]methyl}pyrazolo[1,5-a]pyrimidin-7-amine (C18 H19 Cl N4 O, 342.8 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry). Every binding site with its residues…

Component
YAB
Formula
C18 H19 Cl N4 O
Class
ligand
Structures
1
PDB entries
1

Binding sites

YAB in 1 structure; the first of them:

  • 7G4S · Crystal Structure of rat Autotaxin in complex with… · YAB A901 · binds LEU78, SER81, ILE167, SER169, PHE210, LEU213, TYR214, LEU216 and 12 more

Residues it binds most

PHE 1, LEU 1, SER 1, TRP 1, ALA 1, TYR 1, ILE 1, LYS 1, MET 1 (residue and the binding sites it lines).

Found with

  • ZIF · (8R)-3-(4-chlorophenyl)-5-methyl-N-{[(2R)-oxolan-2-yl]methyl}pyrazolo[1,5-a]pyrimidin-7-amine
  • CA · Calcium ion
  • NA · Sodium ion
  • ZN · Zinc ion
  • BMA · beta-D-mannopyranose
  • MAN · alpha-D-mannopyranose
  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose
  • MLI · Malonate ion

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