Ligand · 9JI
9JI · Avapritinib
9JI, Avapritinib (C26 H27 F N10, 498.6 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry). Every binding site with its residues within 4.5 Å, the residues it binds most and the ligands found with it.
- Component
- 9JI
- Formula
- C26 H27 F N10
- Class
- ligand
- Structures
- 1
- PDB entries
- 1
Binding sites
9JI in 1 structure; the first of them:
- 8PQH · PDGFRA T674I mutant kinase domain in complex with avapritinib · 9JI A1001 · binds ARG597, LEU599, GLY600, SER601, GLY602, GLY605, LYS606, VAL607 and 15 more
Residues it binds most
GLY 1, LEU 1, CYS 1, LYS 1, TYR 1, ALA 1, ARG 1, ASP 1, GLU 1, ILE 1 (residue and the binding sites it lines).
Found with
- PEG · Di(hydroxyethyl)ether
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