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Ligand · 2VI

2VI · 5-[bis(fluoranyl)methoxy]-2-[(4-chlorophenyl)methyl]-10-(3-methoxypropyl)-3,10-diazatricyclo[6.4.1.0^{4, 13}]trideca-1,4(13),5,7-tetraen-9-one

2VI, 5-[bis(fluoranyl)methoxy]-2-[(4-chlorophenyl)methyl]-10-(3-methoxypropyl)-3,10-diazatricyclo[6.4.1.0^{4, 13}]trideca-1,4(13),5,7-tetraen-9-one (C23 H23 Cl F2 N2 O3, 448.9 g/mol), in the MolNFT structures on GenesisL1: bound in 2…

Component
2VI
Formula
C23 H23 Cl F2 N2 O3
Class
ligand
Structures
2
PDB entries
1

Binding sites

2VI in 2 structures; the first of them:

  • 7FAR · Crystal structure of PDE5A in complex with inhibitor L12 · 2VI A903 · binds TYR612, HIS613, HIS617, ASP654, LEU725, ASP764, LEU765, ALA767 and 12 more
  • 7FAR · Crystal structure of PDE5A in complex with inhibitor L12 · 2VI A903 · binds TYR612, HIS613, LEU725, ASP764, LEU765, ALA767, ILE768, GLN775 and 8 more

Residues it binds most

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