Ligand · 3D3
3D3 · 2-[(6-amino-7H-purin-8-yl)thio]acetamide
3D3, 2-[(6-amino-7H-purin-8-yl)thio]acetamide (C7 H8 N6 O S, 224.2 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5 Å, the residues it binds most and the…
- Component
- 3D3
- Formula
- C7 H8 N6 O S
- Class
- ligand
- Structures
- 2
- PDB entries
- 1
Binding sites
3D3 in 2 structures; the first of them:
- 2CGX · Identification of chemically diverse Chk1 inhibitors by receptor- based virtual screening · 3D3 A1274 · binds LEU15, GLY16, GLY18, TYR20, VAL23, ALA36, LYS38, GLU85 and 4 more
- 2CGX · Identification of chemically diverse CHK1 inhibitors by receptor-based virtual screening · 3D3 A1274 · binds LEU15, GLY16, GLY18, TYR20, VAL23, ALA36, LYS38, GLU85 and 4 more
Residues it binds most
GLY 2, LEU 2, TYR 2, ALA 2, ASP 2, CYS 2, GLU 2, LYS 2, VAL 2 (residue and the binding sites it lines).
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