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Ligand · W8L

W8L · 3-(4-chlorophenyl)-5-methylisoquinolin-1(2H)-one

W8L, 3-(4-chlorophenyl)-5-methylisoquinolin-1(2H)-one (C16 H12 Cl N O, 269.7 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…

Component
W8L
Formula
C16 H12 Cl N O
Class
ligand
Structures
2
PDB entries
1

Binding sites

W8L in 2 structures; the first of them:

  • 4UVV · Crystal structure of human tankyrase 2 in complex with 3-(4… · W8L A2162 · binds PHE1030, HIS1031, GLY1032, SER1033, PRO1034, PHE1035, HIS1048, ALA1049 and 9 more
  • 4UVV · Crystal structure of human tankyrase 2 in complex with 3-(4… · W8L A2162 · binds PHE1030, HIS1031, GLY1032, SER1033, PRO1034, PHE1035, HIS1048, ALA1049 and 9 more

Residues it binds most

PHE 4, TYR 4, HIS 4, SER 4, ALA 4, GLU 4, GLY 4, ILE 4, LYS 4, PRO 4 (residue and the binding sites it lines).

Found with

  • ZN · Zinc ion
  • SO4 · Sulfate ion
  • GOL · Glycerol

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