PDB ligand accession: TPS
DrugBank: DB03416
PubChem:
ChEMBL:
InChI Key: HZSAJDVWZRBGIF-UHFFFAOYSA-O
SMILES: Cc1c(sc[n+]1Cc2cnc(nc2N)C)CCOP(=O)(O)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Diazines
- Subclass: Pyrimidines and pyrimidine derivatives
- Class: Diazines
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3C9T | Download | Experimental | e3c9tA1 e3c9tA2 e3c9tB2 e3c9tB1 e3c9tA2 e3c9tB2 | Alpha-beta plaits Bacillus chorismate mutase-like Bacillus chorismate mutase-like Alpha-beta plaits Bacillus chorismate mutase-like Bacillus chorismate mutase-like | LigPlot |