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Ligand · VG2

VG2 · 4-(2-aminoethoxy)-N-(3-chloro-5-piperidin-1-ylphenyl)-3,5-dimethylbenzamide

VG2, 4-(2-aminoethoxy)-N-(3-chloro-5-piperidin-1-ylphenyl)-3,5-dimethylbenzamide (C22 H28 Cl N3 O2, 401.9 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5 Å…

Component
VG2
Formula
C22 H28 Cl N3 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

VG2 in 2 structures; the first of them:

  • 2VIV · Fragment-Based Discovery of Mexiletine Derivatives as Orally Bioavailable Inhibitors of… · VG2 A1247 · binds HIS57, TYR94, HIS99, ASP189, SER190, CYS191, GLN192, SER195 and 7 more
  • 2VIV · Fragment-based discovery of mexiletine derivatives as orally bioavailable inhibitors of… · VG2 A1247 · binds HIS57, TYR94, HIS99, ASP189, SER190, CYS191, GLN192, SER195 and 7 more

Residues it binds most

GLY 2, SER 2, CYS 2, HIS 2, ASP 2, GLN 2, TRP 2, TYR 2, VAL 2 (residue and the binding sites it lines).

Found with

  • ACT · Acetate ion

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