PDB ligand accession: HEC
DrugBank: DB03317
PubChem: n/a
ChEMBL: n/a
InChI Key: HXQIYSLZKNYNMH-LJNAALQVSA-N
SMILES: CC=C1C(=C2C=C3C(=CC)C(=C4N3[Fe]56N2C1=Cc7n5c(c(c7C)CCC(=O)O)C=C8N6C(=C4)C(=C8CCC(=O)O)C)C)C
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Tetrapyrroles and derivatives
- Subclass: Metallotetrapyrroles
- Class: Tetrapyrroles and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5GYR | Download | Experimental | e5gyrA1 e5gyrN1 e5gyrB1 e5gyrE1 e5gyrJ1 e5gyrF1 e5gyrI1 e5gyrJ1 e5gyrN1 e5gyrM1 e5gyrN1 | Four-helical up-and-down bundle Four-helical up-and-down bundle Four-helical up-and-down bundle Four-helical up-and-down bundle Four-helical up-and-down bundle Four-helical up-and-down bundle Four-helical up-and-down bundle Four-helical up-and-down bundle Four-helical up-and-down bundle Four-helical up-and-down bundle Four-helical up-and-down bundle | LigPlot |
1BBH | Download | Experimental | e1bbhA1 e1bbhB1 | Four-helical up-and-down bundle Four-helical up-and-down bundle | LigPlot |