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Ligand · VIA

VIA · 5-{2-ethoxy-5-[(4-methylpiperazin-1-yl)sulfonyl]phenyl}-1-methyl-3-propyl-1H,6H,7H-pyrazolo[4,3-d]pyrimidin-7-one

VIA, 5-{2-ethoxy-5-[(4-methylpiperazin-1-yl)sulfonyl]phenyl}-1-methyl-3-propyl-1H,6H,7H-pyrazolo[4,3-d]pyrimidin-7-one (C22 H30 N6 O4 S, 474.6 g/mol), in the MolNFT structures on GenesisL1: bound in 10 records (5 PDB entries). Every…

Component
VIA
Formula
C22 H30 N6 O4 S
Class
ligand
Structures
10
PDB entries
5

Binding sites

VIA in 10 structures; the first of them:

  • 1TBF · Catalytic Domain Of Human Phosphodiesterase 5A in Complex with Sildenafil · VIA A501 · binds TYR612, HIS613, LEU725, LEU765, ALA767, ILE768, ALA779, VAL782 and 8 more
  • 1UDT · Crystal structure of Human Phosphodiesterase 5 complexed with Sildenafil(Viagra) · VIA A1000 · binds TYR612, HIS613, ASN661, SER663, TYR664, LEU765, ALA767, ILE768 and 9 more
  • 1XOS · Catalytic Domain Of Human Phosphodiesterase 4B In Complex With Sildenafil · VIA A1 · binds TYR233, HIS234, MET347, ASP392, LEU393, ASN395, TYR403, ILE410 and 9 more
  • 2H42 · Crystal structure of PDE5 in complex with sildenafil · VIA A901 · binds TYR612, HIS613, ASN661, ASN662, SER663, ILE665, LEU725, LEU765 and 13 more
  • 3JWQ · Crystal structure of chimeric PDE5/PDE6 catalytic domain complexed with sildenafil · VIA A901 · binds TYR612, HIS613, LEU725, LEU765, ALA767, ALA779, VAL782, PHE786 and 6 more
  • 1TBF · Catalytic domain of human phosphodiesterase 5A in complex with sildenafil · VIA A501 · binds TYR612, HIS613, LEU725, LEU765, ALA767, ILE768, ALA779, VAL782 and 8 more
  • 1UDT · Crystal structure of human phosphodiesterase 5 complexed with SILDENAFIL(VIAGRA) · VIA A1000 · binds TYR612, HIS613, ASN661, SER663, TYR664, LEU765, ALA767, ILE768 and 9 more
  • 1XOS · Catalytic domain of human phosphodiesterase 4B in complex with sildenafil · VIA A1 · binds TYR233, HIS234, MET347, ASP392, LEU393, ASN395, TYR403, ILE410 and 9 more
  • 2H42 · Crystal structure of PDE5 in complex with sildenafil · VIA A901 · binds TYR612, HIS613, ASN661, ASN662, SER663, ILE665, LEU725, LEU765 and 13 more
  • 3JWQ · Crystal structure of chimeric PDE5/PDE6 catalytic domain complexed with sildenafil · VIA A901 · binds TYR612, HIS613, LEU725, LEU765, ALA767, ALA779, VAL782, PHE786 and 6 more

Residues it binds most

LEU 20, ALA 18, ILE 18, PHE 20, GLN 20, TYR 20, MET 20, VAL 18, ASN 14, HIS 20 (residue and the binding sites it lines).

Found with

  • MG · Magnesium ion
  • ZN · Zinc ion
  • SO4 · Sulfate ion
  • GOL · Glycerol

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