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Ligand · AK8

AK8 · 1-[3-methyl-4-({3-[2-(methylamino)pyrimidin-4-yl]pyridin-2-yl}oxy)phenyl]-3-[3-(trifluoromethyl)phenyl]urea

AK8, 1-[3-methyl-4-({3-[2-(methylamino)pyrimidin-4-yl]pyridin-2-yl}oxy)phenyl]-3-[3-(trifluoromethyl)phenyl]urea (C25 H21 F3 N6 O2, 494.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site…

Component
AK8
Formula
C25 H21 F3 N6 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

AK8 in 2 structures; the first of them:

  • 3EFW · Structure of AuroraA with pyridyl-pyrimidine urea inhibitor · AK8 A404 · binds LEU139, GLY140, LYS141, GLY142, LYS143, PHE144, VAL147, ALA160 and 15 more
  • 3EFW · Structure of auroraa with pyridyl-pyrimidine urea inhibitor · AK8 A404 · binds LEU139, GLY140, LYS141, GLY142, LYS143, PHE144, VAL147, ALA160 and 15 more

Residues it binds most

LEU 4, ALA 4, GLY 4, LYS 4, GLU 4, PHE 4, VAL 4, GLN 4, TYR 4, ASN 2 (residue and the binding sites it lines).

Found with

  • SO4 · Sulfate ion

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