PDB ligand accession: TDR
DrugBank: DB03462
PubChem: 1135;5274265;
ChEMBL:
InChI Key: RWQNBRDOKXIBIV-UHFFFAOYSA-N
SMILES: CC1=CNC(=O)NC1=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 |
---|---|---|---|---|---|
8F6N | Download | Experimental | e8f6nA5 e8f6nB2 e8f6nC4 e8f6nD1 | TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel | LigPlot |
8F5W | Download | Experimental | e8f5wA1 e8f5wB2 e8f5wC1 e8f5wD1 | TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel | LigPlot |
7M31 | Download | Experimental | e7m31A4 e7m31B5 e7m31C4 e7m31D5 | TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel | LigPlot |
8F61 | Download | Experimental | e8f61A1 e8f61D2 | TIM beta/alpha-barrel TIM beta/alpha-barrel | LigPlot |