Ligand · 2YQ
2YQ · (8S,9R)-5-fluoro-8-(4-fluorophenyl)-9-(1-methyl-1H-1,2, 4-triazol-5-yl)-2,7,8,9-tetrahydro-3H-pyrido[4,3,2-de]phthalazin-3-one
2YQ, (8S,9R)-5-fluoro-8-(4-fluorophenyl)-9-(1-methyl-1H-1,2, 4-triazol-5-yl)-2,7,8,9-tetrahydro-3H-pyrido[4,3,2-de]phthalazin-3-one (C19 H14 F2 N6 O, 380.4 g/mol), in the MolNFT structures on GenesisL1: bound in 3 records (2 PDB entries).…
- Component
- 2YQ
- Formula
- C19 H14 F2 N6 O
- Class
- ligand
- Structures
- 3
- PDB entries
- 2
Binding sites
2YQ in 3 structures; the first of them:
- 7KKN · Structure of the catalytic domain of tankyrase 1 in complex with talazoparib · 2YQ A9002 · binds PHE1183, HIS1184, GLY1185, GLY1205, GLY1206, TYR1213, PHE1214, ALA1215 and 5 more
- 7KK3 · Structure of the catalytic domain of PARP1 in complex with talazoparib · 2YQ A9001 · binds GLU763, TRP861, HIS862, GLY863, GLY888, TYR889, TYR896, PHE897 and 5 more
- 7KKN · Structure of the catalytic domain of tankyrase 1 in complex with talazoparib · 2YQ A9002 · binds PHE1183, HIS1184, GLY1185, GLY1205, GLY1206, TYR1213, PHE1214, ALA1215 and 5 more
Residues it binds most
GLY 12, TYR 12, PHE 12, GLU 12, ALA 12, HIS 12, LYS 12, SER 12, ILE 8, TRP 4 (residue and the binding sites it lines).
Found with
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