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Ligand · 3YY

3YY · (5R)-5-[3-(4-fluorophenyl)-1-phenyl-1H-pyrazol-4-yl]imidazolidine-2,4-dione

3YY, (5R)-5-[3-(4-fluorophenyl)-1-phenyl-1H-pyrazol-4-yl]imidazolidine-2,4-dione (C18 H13 F N4 O2, 336.3 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…

Component
3YY
Formula
C18 H13 F N4 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

3YY in 2 structures; the first of them:

  • 3PYY · Discovery and Characterization of a Cell-Permeable, Small-molecule c-Abl Kinase Activator… · 3YY A538 · binds ALA356, LEU359, LEU360, ALA363, LEU448, ILE451, ALA452, TYR454 and 6 more
  • 3PYY · Discovery and characterization of a cell-permeable, small-molecule C- abl kinase… · 3YY A538 · binds ALA356, LEU359, LEU360, ALA363, LEU448, ILE451, ALA452, TYR454 and 6 more

Residues it binds most

ALA 4, LEU 4, GLU 4, CYS 4, GLY 4, ILE 4, PRO 4, SER 4, TYR 4, VAL 4 (residue and the binding sites it lines).

Found with

  • STI · 4-(4-methyl-piperazin-1-ylmethyl)-N-[4-methyl-3-(4-pyridin-3-yl-pyrimidin-2-ylamino)-phenyl]-benzamide
  • SO4 · Sulfate ion
  • 2PE · Nonaethylene glycol
  • GOL · Glycerol

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