PDB ligand accession: 1RL
DrugBank: n/a
PubChem: n/a
ChEMBL: n/a
InChI Key: NCYSEZCFZIFVEB-WLRQHHRRSA-N
SMILES: CCN(CC)CCOc1cccc2c1N=C3c4c5c(c(c6c4C(=O)C(O6)(OC=CC(C(C(C(C(C(C(C(C=CC=C(C(=O)NC(=C3O2)C5=O)C)C)O)C)O)C)OC(=O)C)C)OC)C)C)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Benzoxazines
- Subclass: Phenoxazines
- Class: Benzoxazines
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4KN4 | Download | Experimental | e4kn4C4 e4kn4C10 e4kn4X3 e4kn4C1 e4kn4H4 e4kn4Y2 e4kn4H10 e4kn4H1 | barrel domain in beta subunit of DNA dependent RNA-polymerase N-terminal domain in beta subunit of DNA dependent RNA-polymerase HTH alpha/beta-Hammerhead/Barrel-sandwich hybrid barrel domain in beta subunit of DNA dependent RNA-polymerase HTH N-terminal domain in beta subunit of DNA dependent RNA-polymerase alpha/beta-Hammerhead/Barrel-sandwich hybrid | LigPlot |