Ligand · I73
I73 · (3S,4S)-4-[[[7-[(phenylmethyl)amino]-3-propan-2-yl-pyrazolo[1,5-a]pyrimidin-5-yl]amino]methyl]piperidin-3-ol
I73, (3S,4S)-4-[[[7-[(phenylmethyl)amino]-3-propan-2-yl-pyrazolo[1,5-a]pyrimidin-5-yl]amino]methyl]piperidin-3-ol (C22 H30 N6 O, 394.5 g/mol), in the MolNFT structures on GenesisL1: bound in 3 records (2 PDB entries). Every binding site…
- Component
- I73
- Formula
- C22 H30 N6 O
- Class
- ligand
- Structures
- 3
- PDB entries
- 2
Binding sites
I73 in 3 structures; the first of them:
- 5JQ8 · Crystal structure of CDK2 in complex with inhibitor ICEC0943 · I73 A301 · binds GLU8, ILE10, GLY11, GLU12, GLY13, VAL18, ALA31, LYS33 and 14 more
- 8P77 · Cryo-EM structure of CAK in complex with inhibitor ICEC0943 · I73 J401 · binds LEU18, VAL26, ALA39, LYS41, ILE75, PHE91, ASP92, PHE93 and 10 more
- 5JQ8 · Crystal structure of CDK2 in complex with inhibitor ICEC0943 · I73 A301 · binds GLU8, ILE10, GLY11, GLU12, GLY13, VAL18, ALA31, LYS33 and 14 more
Residues it binds most
ASP 3, GLU 3, ALA 3, LEU 3, PHE 3, VAL 3, LYS 3, ASN 3, GLN 2, GLY 2 (residue and the binding sites it lines).
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