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Ligand · 91Q

91Q · 3-[2-(dimethylamino)ethyl]-1~{H}-indol-4-ol

91Q, 3-[2-(dimethylamino)ethyl]-1~{H}-indol-4-ol (C12 H16 N2 O, 204.3 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…

Component
91Q
Formula
C12 H16 N2 O
Class
ligand
Structures
3
PDB entries
2

Binding sites

91Q in 3 structures; the first of them:

  • 7WC5 · Crystal structure of serotonin 2A receptor in complex with psilocin · 91Q A1206 · binds TRP151, ASP155, VAL156, CYS227, LEU228, TRP336, PHE339, ASN343 and 4 more
  • 7WC5 · Crystal structure of serotonin 2A receptor in complex with psilocin · 91Q A1206 · binds TRP151, ASP155, VAL156, LEU228, PHE339, ASN343, ASN363
  • 8DPG · Cryo-EM structure of the 5HT2C receptor (ini isoform) bound to psilocin · 91Q A501 · binds ASP134, VAL135, SER138, PHE214, GLY218, SER219, ALA222, PHE327 and 2 more

Residues it binds most

VAL 3, ASN 2, PHE 3, ASP 3, LEU 2, TRP 2, SER 1, TYR 2, ALA 1, CYS 1 (residue and the binding sites it lines).

Found with

  • CLR · Cholesterol
  • MG · Magnesium ion
  • OLC · (2R)-2,3-dihydroxypropyl (9Z)-octadec-9-enoate

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