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Ligand · AEX

AEX · N-butyl-9H-beta-carbolin-3-amine

AEX, N-butyl-9H-beta-carbolin-3-amine (C15 H17 N3, 239.3 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 found…

Component
AEX
Formula
C15 H17 N3
Class
ligand
Structures
2
PDB entries
1

Binding sites

AEX in 2 structures; the first of them:

  • 7CE8 · Crystal structure of T2R-TTL-Compound11 complex · AEX B504 · binds TYR50, GLN134, ASN165, PHE167, GLU198, TYR200, VAL236, THR237 and 10 more
  • 7CE8 · Crystal structure of T2R-ttl-COMPOUND11 complex · AEX B504 · binds GLN134, ASN165, PHE167, GLU198, TYR200, VAL236, THR237, CYS239 and 8 more

Residues it binds most

LEU 4, ALA 4, ILE 4, TYR 4, ASN 4, CYS 4, GLN 4, GLU 4, MET 4, PHE 4 (residue and the binding sites it lines).

Found with

  • ACP · Phosphomethylphosphonic acid adenylate ester
  • GDP · Guanosine-5'-diphosphate
  • GTP · Guanosine-5'-triphosphate
  • CA · Calcium ion
  • MG · Magnesium ion
  • GOL · Glycerol
  • MES · 2-(N-morpholino)-ethanesulfonic acid

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