PDB ligand accession: GBS
DrugBank: DB02459
PubChem:
ChEMBL:
InChI Key: SXTSBZBQQRIYCU-UHFFFAOYSA-N
SMILES: c1cc(ccc1C(=O)O)NC(=N)N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Benzoic acids and derivatives
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
6ZOV | Download | Experimental | e6zovA1 e6zovB1 e6zovC1 e6zovD1 | cradle loop barrel cradle loop barrel cradle loop barrel cradle loop barrel | LigPlot |
7WR7 | Download | Experimental | e7wr7B1 | cradle loop barrel | LigPlot |