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Ligand · 5CO

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

5CO, 5-chloro-6-ethyl-2-{5-[(4-methylpiperazin-1-yl)sulfonyl]-2-propoxyphenyl}pyrimidin-4(3H)-one (C20 H27 Cl N4 O4 S, 455.0 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its…

Component
5CO
Formula
C20 H27 Cl N4 O4 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

5CO in 2 structures; the first of them:

  • 3SHZ · Crystal structure of the PDE5A1 catalytic domain in complex with novel inhibitors · 5CO A1 · binds TYR612, LEU765, ALA767, ALA779, VAL782, ALA783, PHE786, ILE813 and 3 more
  • 3SHZ · Crystal structure of the PDE5A1 catalytic domain in complex with novel inhibitors · 5CO A1 · binds TYR612, LEU765, ALA767, ALA779, VAL782, ALA783, PHE786, ILE813 and 3 more

Residues it binds most

ALA 2, PHE 2, GLN 2, ILE 2, LEU 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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