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Ligand · AT3

AT3 · Acetylthiocholine

AT3, Acetylthiocholine (C7 H16 N O S +1, 162.3 g/mol), in the MolNFT structures on GenesisL1: bound in 3 records (2 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and the ligands found with it.

Component
AT3
Formula
C7 H16 N O S +1
Class
ligand
Structures
3
PDB entries
2

Binding sites

AT3 in 3 structures; the first of them:

  • 6UQY · Crystal structure of ChoE H288N mutant in complex with acetylthiocholine · AT3 A401 · binds ASP37, SER38, TYR39, TRP73, GLY97, GLY98, TYR106, TYR107 and 5 more
  • 6UQY · Crystal structure of choe H288N mutant in complex with acetylthiocholine · AT3 A401 · binds ASP37, SER38, TYR39, GLY98, TYR106, TYR107, ALA146, ASN147 and 1 more
  • 6UR1 · Crystal structure of choe S38A mutant in complex with acetate and acetylthiocholine · AT3 A402 · binds TYR68, TRP73, TYR106, TYR107, ASN147, PHE150, TRP287, HIS288

Residues it binds most

TYR 6, TRP 6, ASN 6, GLY 4, PHE 5, ALA 4, ASP 4, SER 4, HIS 2 (residue and the binding sites it lines).

Found with

  • GOL · Glycerol
  • ACT · Acetate ion

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