GL1X · GenesisL1 explorer

Ligand · 93F

93F · (10~{R},15~{S})-12-[3-(2-methoxyphenyl)propyl]-4-methyl-1,4,12-triazatetracyclo[7.6.1.0^{5,16}.0^{10, 15}]hexadeca-5(16),6,8-triene

93F, (10~{R},15~{S})-12-[3-(2-methoxyphenyl)propyl]-4-methyl-1,4,12-triazatetracyclo[7.6.1.0^{5,16}.0^{10, 15}]hexadeca-5(16),6,8-triene (C24 H31 N3 O, 377.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry).…

Component
93F
Formula
C24 H31 N3 O
Class
ligand
Structures
2
PDB entries
1

Binding sites

93F in 2 structures; the first of them:

  • 7WC9 · Crystal structure of serotonin 2A receptor in complex with non-hallucinogenic psychedelic… · 93F A1206 · binds TRP151, ASP155, SER159, LEU228, LEU229, VAL235, SER239, PHE243 and 9 more
  • 7WC9 · Crystal structure of serotonin 2A receptor in complex with non- hallucinogenic… · 93F A1206 · binds ASP155, SER159, LEU228, LEU229, PHE243, PHE332, TRP336, PHE339 and 5 more

Residues it binds most

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

Found with

  • CLR · Cholesterol
  • MG · Magnesium ion
  • 1PE · Pentaethylene glycol
  • OLC · (2R)-2,3-dihydroxypropyl (9Z)-octadec-9-enoate
  • PEG · Di(hydroxyethyl)ether

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