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Ligand · 09O

09O · 1-(pyridin-3-yl)-1,4-diazepane

09O, 1-(pyridin-3-yl)-1,4-diazepane (C10 H15 N3, 177.2 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 found…

Component
09O
Formula
C10 H15 N3
Class
ligand
Structures
2
PDB entries
1

Binding sites

09O in 2 structures; the first of them:

  • 3U8J · Crystal structure of the acetylcholine binding protein (AChBP) from Lymnaea stagnalis in… · 09O B211 · binds TYR89, SER142, TRP143, THR144, TYR185, CYS187, CYS188, TYR192 and 4 more
  • 3U8J · Crystal structure of the acetylcholine binding protein (achbp) from lymnaea stagnalis in… · 09O B211 · binds TYR89, SER142, TRP143, THR144, TYR185, CYS187, CYS188, TYR192 and 4 more

Residues it binds most

TYR 20, CYS 20, TRP 20, ARG 20, LEU 20, MET 20, SER 20, THR 20 (residue and the binding sites it lines).

Found with

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose
  • SO4 · Sulfate ion

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