Ligand · A1A1E
A1A1E · 4-(aminomethyl)-2-{6-[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]pyridin-2-yl}-2,3-dihydro-1H-isoindol-1-one
A1A1E, 4-(aminomethyl)-2-{6-[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]pyridin-2-yl}-2,3-dihydro-1H-isoindol-1-one (C19 H20 N6 O, 348.4 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry). Every binding site with its…
- Component
- A1A1E
- Formula
- C19 H20 N6 O
- Class
- ligand
- Structures
- 1
- PDB entries
- 1
Binding sites
A1A1E in 1 structure; the first of them:
- 9CZT · HPK1 kinase domain T165E,S171E phosphomimetic mutant in complex with compound 6 · A1A1E A401 · binds LEU23, GLY25, GLY26, VAL31, ALA44, LYS46, VAL75, MET91 and 10 more
Residues it binds most
ALA 2, GLY 2, ASP 2, LEU 2, VAL 2, ASN 2, CYS 2, GLU 2, LYS 2, MET 2 (residue and the binding sites it lines).
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