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Ligand · 5IO

5IO · 6-ethyl-5-iodo-2-{5-[(4-methylpiperazin-1-yl)sulfonyl]-2-propoxyphenyl}pyrimidin-4(3H)-one

5IO, 6-ethyl-5-iodo-2-{5-[(4-methylpiperazin-1-yl)sulfonyl]-2-propoxyphenyl}pyrimidin-4(3H)-one (C20 H27 I N4 O4 S, 546.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues…

Component
5IO
Formula
C20 H27 I N4 O4 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

5IO in 2 structures; the first of them:

  • 4OEW · Crystal structure of the PDE5A1 catalytic domain in complex with novel inhibitors · 5IO A903 · binds TYR612, HIS613, LEU725, LEU765, ALA767, ILE768, GLN775, ALA779 and 9 more
  • 4OEW · Crystal structure of the PDE5A1 catalytic domain in complex with novel inhibitors · 5IO A903 · binds TYR612, HIS613, LEU725, LEU765, ALA767, ILE768, GLN775, ALA779 and 9 more

Residues it binds most

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

Found with

  • MG · Magnesium ion
  • ZN · Zinc ion

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