Ligand · 89F
89F · 1-methyl-4-[(5~{S})-3-methylsulfanyl-5,6-dihydrobenzo[b][1]benzothiepin-5-yl]piperazine
89F, 1-methyl-4-[(5~{S})-3-methylsulfanyl-5,6-dihydrobenzo[b][1]benzothiepin-5-yl]piperazine (C20 H24 N2 S2, 356.6 g/mol), in the MolNFT structures on GenesisL1: bound in 3 records (2 PDB entries). Every binding site with its residues…
- Component
- 89F
- Formula
- C20 H24 N2 S2
- Class
- ligand
- Structures
- 3
- PDB entries
- 2
Binding sites
89F in 3 structures; the first of them:
- 6WH4 · Crystal structure of HTR2A with inverse agonist · 89F A1201 · binds TRP151, ASP155, VAL156, SER159, THR160, ILE163, LEU229, VAL235 and 9 more
- 5V54 · Crystal structure of 5-HT1B receptor in complex with methiothepin · 89F A1201 · binds TRP125, LEU126, ASP129, ILE130, CYS133, THR134, ILE137, VAL201 and 8 more
- 6WH4 · Crystal structure of HTR2A with inverse agonist · 89F A1201 · binds TRP151, ASP155, VAL156, SER159, THR160, ILE163, LEU229, VAL235 and 6 more
Residues it binds most
SER 8, VAL 8, PHE 8, TRP 8, THR 8, ASP 8, ILE 5, LEU 8, TYR 8, GLY 6 (residue and the binding sites it lines).
Found with
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