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Ligand · I19

I19 · N-(4-{[(3S)-3-(dimethylamino)pyrrolidin-1-yl]carbonyl}phenyl)-5-fluoro-4-[2-methyl-1-(1-methylethyl)-1H-imidazol-5-yl]pyrimidin-2-amine

I19, N-(4-{[(3S)-3-(dimethylamino)pyrrolidin-1-yl]carbonyl}phenyl)-5-fluoro-4-[2-methyl-1-(1-methylethyl)-1H-imidazol-5-yl]pyrimidin-2-amine (C24 H30 F N7 O, 451.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB…

Component
I19
Formula
C24 H30 F N7 O
Class
ligand
Structures
2
PDB entries
1

Binding sites

I19 in 2 structures; the first of them:

  • 2W17 · CDK2 in complex with the imidazole pyrimidine amide, compound (S)-8b · I19 A1300 · binds ILE10, GLY11, VAL18, ALA31, LYS33, VAL64, PHE80, GLU81 and 11 more
  • 2W17 · CDK2 in complex with the imidazole pyrimidine amide, compound (S)-8B · I19 A1300 · binds ILE10, GLY11, VAL18, ALA31, LYS33, VAL64, PHE80, GLU81 and 11 more

Residues it binds most

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

Found with

  • ACT · Acetate ion
  • ACE · Acetyl group

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