PDB ligand accession: THM
DrugBank: DB04485
PubChem:
ChEMBL:
InChI Key: IQFYYKKMVGJFEH-XLPZGREQSA-N
SMILES: CC1=CN(C(=O)NC1=O)C2CC(C(O2)CO)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Nucleosides, nucleotides, and analogues
- Class: Pyrimidine nucleosides
- Subclass: Pyrimidine 2'-deoxyribonucleosides
- Class: Pyrimidine nucleosides
- Superclass: Nucleosides, nucleotides, and analogues
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3ROE | Download | Experimental | e3roeA1 e3roeB1 e3roeC1 e3roeD1 e3roeE1 e3roeF1 | Rossmann-like Rossmann-like Rossmann-like Rossmann-like Rossmann-like Rossmann-like | LigPlot |