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Ligand · I40

I40 · 9-(3-iodobenzylamino)-1,2,3,4-tetrahydroacridine

I40, 9-(3-iodobenzylamino)-1,2,3,4-tetrahydroacridine (C20 H19 I N2, 414.3 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…

Component
I40
Formula
C20 H19 I N2
Class
ligand
Structures
2
PDB entries
1

Binding sites

I40 in 2 structures; the first of them:

  • 6XYU · Update of AChE from Drosophila Melanogaster complex with tacrine derivative… · I40 A601 · binds TYR71, GLY79, TRP83, GLY149, GLY150, GLY151, TYR162, GLU237 and 7 more
  • 6XYU · Update of ache from drosophila melanogaster complex with tacrine derivative… · I40 A601 · binds TYR71, TRP83, GLY149, GLY150, GLY151, GLU237, PHE330, TYR370 and 5 more

Residues it binds most

GLY 2, TYR 2, PHE 2, TRP 2, GLU 2, HIS 2, LEU 2 (residue and the binding sites it lines).

Found with

  • BMA · beta-D-mannopyranose
  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose
  • IOD · Iodide ion

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