PDB ligand accession: THG
DrugBank: DB02031
PubChem: 5289465;5460413;135398650;
ChEMBL: n/a
InChI Key: MSTNYGQPCMXVAQ-RYUDHWBXSA-N
SMILES: c1cc(ccc1C(=O)NC(CCC(=O)O)C(=O)O)NCC2CNC3=C(N2)C(=O)NC(=N3)N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pteridines and derivatives
- Subclass: Pterins and derivatives
- Class: Pteridines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5T7O | Download | Experimental | e5t7oA2 e5t7oB1 e5t7oC2 e5t7oD1 | Dihydrofolate reductases Dihydrofolate reductases Dihydrofolate reductases Dihydrofolate reductases | LigPlot |