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Ligand · 89I

89I · 5-[4-(dimethylamino)phenyl]-6-[(6-morpholin-4-ylpyridin-3-yl)ethynyl]pyrimidin-4-amine

89I, 5-[4-(dimethylamino)phenyl]-6-[(6-morpholin-4-ylpyridin-3-yl)ethynyl]pyrimidin-4-amine (C23 H24 N6 O, 400.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within…

Component
89I
Formula
C23 H24 N6 O
Class
ligand
Structures
2
PDB entries
1

Binding sites

89I in 2 structures; the first of them:

  • 2I6B · Human Adenosine Kinase in Complex with An Acetylinic Inhibitor · 89I A500 · binds ASN14, LEU16, GLN38, ILE39, LEU40, GLY64, SER65, ALA136 and 5 more
  • 2I6B · Human adenosine kinase in complex with an acetylinic inhibitor · 89I A500 · binds ASN14, LEU16, GLN38, ILE39, LEU40, GLY64, SER65, ALA136 and 5 more

Residues it binds most

LEU 4, PHE 4, ALA 4, ASN 4, GLN 4, GLY 4, ILE 4, SER 4, THR 4, TYR 4 (residue and the binding sites it lines).

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