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Ligand · VT3

VT3 · 8-hydroxy-2-(4-methylphenyl)-3,4-dihydroquinazolin-4-one

VT3, 8-hydroxy-2-(4-methylphenyl)-3,4-dihydroquinazolin-4-one (C15 H12 N2 O2, 252.3 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…

Component
VT3
Formula
C15 H12 N2 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

VT3 in 2 structures; the first of them:

  • 4UI7 · Crystal structure of human tankyrase 2 in complex with TA-49 · VT3 A2116 · binds PHE1030, HIS1031, GLY1032, SER1033, PRO1034, PHE1035, HIS1048, ALA1049 and 9 more
  • 4UI7 · Crystal structure of human tankyrase 2 in complex with ta-49 · VT3 A2116 · binds PHE1030, HIS1031, GLY1032, SER1033, PRO1034, PHE1035, HIS1048, ALA1049 and 9 more

Residues it binds most

PHE 4, TYR 4, ALA 4, HIS 4, SER 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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