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Ligand · VL9

VL9 · [(1~{S})-2-[3,5-bis(chloranyl)-1-oxidanyl-pyridin-4-yl]-1-(3,4-dimethoxyphenyl)ethyl] 5-[[[(1~{R})-2-[[(3~{R})-1-azabicyclo[2.2.2]octan-3-yl]oxy]-2-oxidanylidene-1-phenyl-ethyl]amino]methyl]thiophene-2-carboxylate

VL9, [(1~{S})-2-[3,5-bis(chloranyl)-1-oxidanyl-pyridin-4-yl]-1-(3,4-dimethoxyphenyl)ethyl] 5-[[[(1~{R})-2-[[(3~{R})-1-azabicyclo[2.2.2]octan-3-yl]oxy]-2-oxidanylidene-1-phenyl-ethyl]amino]methyl]thiophene-2-carboxylate (C36 H38 Cl2 N3 O7…

Component
VL9
Formula
C36 H38 Cl2 N3 O7 S
Class
ligand
Structures
1
PDB entries
1

Binding sites

VL9 in 1 structure; the first of them:

  • 8OEG · PDE4B bound to MAPI compound 92a · VL9 A703 · binds TYR405, HIS406, GLU476, THR517, ASP518, MET519, ASP564, LEU565 and 14 more

Residues it binds most

TYR 1, ASP 1, ILE 1, MET 1, PHE 1, THR 1, ASN 1, GLN 1, GLU 1, GLY 1 (residue and the binding sites it lines).

Found with

  • MG · Magnesium ion
  • ZN · Zinc ion

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