PDB ligand accession: MEF
DrugBank: DB12676
PubChem: 445117;5288808;135398645;163026559;163026560;
ChEMBL:
InChI Key: QYNUQALWYRSVHF-OLZOCXBDSA-N
SMILES: c1cc(ccc1C(=O)NC(CCC(=O)O)C(=O)O)N2CC3CNC4=C(N3C2)C(=O)NC(=N4)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 |
---|---|---|---|---|---|
4GT9 | Download | Experimental | e4gt9A1 | Thymidylate synthase-complementing protein Thy1 | LigPlot |
4GTE | Download | Experimental | e4gteC1 e4gteB1 e4gteD1 e4gteA1 | Thymidylate synthase-complementing protein Thy1 Thymidylate synthase-complementing protein Thy1 Thymidylate synthase-complementing protein Thy1 Thymidylate synthase-complementing protein Thy1 | LigPlot |
4GTF | Download | Experimental | e4gtfA1 | Thymidylate synthase-complementing protein Thy1 | LigPlot |