Ligand · 1PU
1PU · 1-(5-oxo-2,3,5,9B-tetrahydro-1H-pyrrolo[2,1-a]isoindol-9-yl)-3-pyridin-2-yl-urea
1PU, 1-(5-oxo-2,3,5,9B-tetrahydro-1H-pyrrolo[2,1-a]isoindol-9-yl)-3-pyridin-2-yl-urea (C17 H16 N4 O2, 308.3 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every binding site with its residues within 4.5…
- Component
- 1PU
- Formula
- C17 H16 N4 O2
- Class
- ligand
- Structures
- 4
- PDB entries
- 2
Binding sites
1PU in 4 structures; the first of them:
- 1GIH · Human cyclin dependent kinase 2 complexed with the CDK4 inhibitor · 1PU A501 · binds ILE10, GLU12, VAL18, ALA31, LYS33, VAL64, PHE80, GLU81 and 10 more
- 1GII · Human cyclin dependent kinase 2 complexed with the CDK4 inhibitor · 1PU A501 · binds ILE10, VAL18, ALA31, LYS33, VAL64, PHE80, GLU81, HIS82 and 8 more
- 1GIH · Human cyclin dependent kinase 2 complexed with the CDK4 inhibitor · 1PU A501 · binds ILE10, GLU12, VAL18, ALA31, LYS33, VAL64, PHE80, GLU81 and 10 more
- 1GII · Human cyclin dependent kinase 2 complexed with the CDK4 inhibitor · 1PU A501 · binds ILE10, VAL18, ALA31, LYS33, VAL64, PHE80, GLU81, HIS82 and 8 more
Residues it binds most
VAL 4, ALA 4, ASP 4, GLN 4, GLU 4, HIS 4, LEU 4, PHE 4, ILE 4, LYS 4 (residue and the binding sites it lines).
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