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Ligand · A64

A64 · 4'-isopropylflavone

A64, 4'-isopropylflavone (C18 H16 O2, 264.3 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 most and the ligands found with it.

Component
A64
Formula
C18 H16 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

A64 in 2 structures; the first of them:

  • 4BS4 · Crystal structure of human tankyrase 2 in complex with 4'-isopropylflavone · A64 A2165 · binds PHE1030, HIS1031, GLY1032, SER1033, PRO1034, PHE1035, ARG1047, HIS1048 and 10 more
  • 4BS4 · Crystal structure of human tankyrase 2 in complex with 4'- isopropylflavone · A64 A2165 · binds PHE1030, HIS1031, GLY1032, SER1033, PRO1034, PHE1035, ARG1047, HIS1048 and 10 more

Residues it binds most

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

Found with

  • ZN · Zinc ion
  • SO4 · Sulfate ion
  • GOL · Glycerol
  • PEG · Di(hydroxyethyl)ether

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