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Ligand · 9ZE

9ZE · 1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanone

9ZE, 1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanone (C10 H10 O3, 178.2 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…

Component
9ZE
Formula
C10 H10 O3
Class
ligand
Structures
2
PDB entries
1

Binding sites

9ZE in 2 structures; the first of them:

  • 4LM3 · Crystal structure of PDE10A2 with fragment ZT464 · 9ZE A801 · binds TYR524, LEU675, SER677, VAL678, THR688, ALA689, ILE692, TYR693 and 4 more
  • 4LM3 · Crystal structure of PDE10A2 with fragment ZT464 · 9ZE A801 · binds TYR524, LEU675, SER677, VAL678, THR688, ALA689, ILE692, TYR693 and 4 more

Residues it binds most

PHE 2, TYR 2, ALA 2, GLN 2, ILE 2, LEU 2, MET 2, SER 2, THR 2, VAL 2 (residue and the binding sites it lines).

Found with

  • NI · Nickel (II) ion
  • EDO · 1,2-ethanediol

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