PDB ligand accession: RID
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: XLVZRBHNHHAPDT-JWQCQUIFSA-N
SMILES: CC(C)c1c(c(c(n1CCC(CC(CC(=O)O)O)O)c2ccc(cc2)F)c3ccccc3)S(=O)(=O)N4CCOCC4
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyrroles
- Subclass: Substituted pyrroles
- Class: Pyrroles
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3BGL | Download | Experimental | e3bglA1 e3bglA2 e3bglB2 e3bglA2 e3bglB1 e3bglB2 e3bglC1 e3bglD2 e3bglC2 e3bglD1 e3bglD2 | Alpha-beta plaits Alpha-beta plaits Alpha-beta plaits Alpha-beta plaits Alpha-beta plaits Alpha-beta plaits Alpha-beta plaits Alpha-beta plaits Alpha-beta plaits Alpha-beta plaits Alpha-beta plaits | LigPlot |