Ligand · 42C
42C · N,N-dimethyl-7H-purin-6-amine
42C, N,N-dimethyl-7H-purin-6-amine (C7 H9 N5, 163.2 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (3 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and the ligands found with…
- Component
- 42C
- Formula
- C7 H9 N5
- Class
- ligand
- Structures
- 4
- PDB entries
- 3
Binding sites
42C in 4 structures; the first of them:
- 7BJH · Crystal structure of CHK1-10pt-mutant complex with compound 8 · 42C A301 · binds LEU15, GLY16, VAL23, ALA36, ILE68, MET84, GLU85, LEU86 and 2 more
- 7ULK · Human TRAP1 NM in complex with 42C · 42C A601 · binds ASN119, ALA120, ALA123, ASP158, ILE161, GLY162, MET163, ASN171 and 2 more
- 7ULL · Human Grp94 N-terminal domain in complex with 42C · 42C A401 · binds ASN107, ALA108, ALA111, ASP149, GLY153, MET154, LEU163, PHE199 and 1 more
- 7BJH · Crystal structure of CHK1-10PT-mutant complex with compound 8 · 42C A301 · binds LEU15, VAL23, ALA36, MET84, GLU85, LEU86, ALA87, LEU137
Residues it binds most
ALA 6, LEU 4, ASN 4, MET 6, ASP 4, GLY 4, ILE 4, PHE 4, THR 4, GLU 2 (residue and the binding sites it lines).
Found with
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