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Ligand · G8V

G8V · 1-benzyl-4-(dimethylamino)pyridinium

G8V, 1-benzyl-4-(dimethylamino)pyridinium (C14 H17 N2 +1, 213.3 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, the residues it binds most and the ligands…

Component
G8V
Formula
C14 H17 N2 +1
Class
ligand
Structures
2
PDB entries
1

Binding sites

G8V in 2 structures; the first of them:

  • 4CG8 · Human choline kinase a1 in complex with compound 14 · G8V A1459 · binds ARG270, ALA428, LYS429, SER431, ILE433, GLU434, PHE435, TYR437
  • 4CG8 · Human choline kinase A1 in complex with compound 14 · G8V A1459 · binds ARG270, ALA428, LYS429, SER431, ILE433, GLU434, PHE435, TYR437

Residues it binds most

ALA 2, ARG 2, GLU 2, ILE 2, LYS 2, PHE 2, SER 2, TYR 2 (residue and the binding sites it lines).

Found with

  • G8S · 4-[(4-chlorophenyl)(methyl)amino]-1-{4-[4-(4-{[4-(dimethylamino)pyridinium-1-yl]methyl}phenyl)butyl]benzyl}pyridinium

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