PDB ligand accession: KI3
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: PNCPOBGZUHFDDF-UHFFFAOYSA-N
SMILES: Cc1cc(nc2c1c(c(s2)C(=O)c3ccccc3)N)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic oxygen compounds
- Class: Organooxygen compounds
- Subclass: Carbonyl compounds
- Class: Organooxygen compounds
- Superclass: Organic oxygen compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5HS3 | Download | Experimental | e5hs3A1 e5hs3B1 e5hs3E1 | Thymidylate synthase/dCMP hydroxymethylase Thymidylate synthase/dCMP hydroxymethylase Thymidylate synthase/dCMP hydroxymethylase | LigPlot |