PDB ligand accession: HBI
DrugBank: DB04400
PubChem: 119055;5288515;135398687;
ChEMBL: n/a
InChI Key: FEMXZDUTFRTWPE-DZSWIPIPSA-N
SMILES: CC(C(C1=NC2=C(NC1)N=C(NC2=O)N)O)O
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 |
---|---|---|---|---|---|
1JWK | Download | Experimental | e1jwkA1 e1jwkB1 | Nitric oxide (NO) synthase oxygenase domain Nitric oxide (NO) synthase oxygenase domain | LigPlot |
2BHJ | Download | Experimental | e2bhjA1 | Nitric oxide (NO) synthase oxygenase domain | LigPlot |
3E7T | Download | Experimental | e3e7tA1 e3e7tB1 | Nitric oxide (NO) synthase oxygenase domain Nitric oxide (NO) synthase oxygenase domain | LigPlot |