GL1X · GenesisL1 explorer

Ligand · WSR

WSR · (1R,3aS,3bR,5aR,7R,9aS,9bS,11aR)-1-[(2R)-6-fluoro-5-oxohexan-2-yl]-9a,11a-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-7-yl hydrogen sulfate (non-preferred name)

WSR, (1R,3aS,3bR,5aR,7R,9aS,9bS,11aR)-1-[(2R)-6-fluoro-5-oxohexan-2-yl]-9a,11a-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-7-yl hydrogen sulfate (non-preferred name) (C25 H41 F O5 S, 472.6 g/mol), in the MolNFT structures on…

Component
WSR
Formula
C25 H41 F O5 S
Class
ligand
Structures
4
PDB entries
4

Binding sites

WSR in 4 structures; the first of them:

  • 8ESG · Bile Salt Hydrolase B from Lactobacillus gasseri with covalent inhibitor bound · WSR A401 · binds CYS2, ARG16, LEU18, ASP19, TYR20, TYR24, GLN26, LEU63 and 12 more
  • 8ESI · Bile Salt Hydrolase from B. longum with covalent inhibitor bound · WSR A401 · binds CYS2, ARG18, LEU20, ASP21, TRP22, TYR26, VAL59, MET66 and 13 more
  • 8ESL · Bile Salt Hydrolase from a Bacteroidales species with covalent inhibitor bound · WSR A401 · binds CYS2, ARG18, LEU20, ASP21, TRP22, GLY61, TYR62, GLY64 and 13 more
  • 8VSY · Bile salt hydrolase from Arthrobacter citreus with covalent inhibitor AAA-10 bound · WSR A408 · binds CYS2, LEU20, ASP21, TRP22, PHE26, ILE58, LEU65, TYR66 and 16 more

Residues it binds most

LEU 16, PHE 16, ASN 16, GLY 16, TYR 16, SER 16, CYS 16, ASP 16, ARG 14, GLN 9 (residue and the binding sites it lines).

Found with

  • MG · Magnesium ion
  • CL · Chloride ion
  • GOL · Glycerol

GL1X is a live explorer of the GenesisL1 blockchain. Turn on JavaScript for search, charts and interactive views.