PDB ligand accession: ML1
DrugBank: DB01065
InChI Key: DRLFMBDRBRZALE-UHFFFAOYSA-N
SMILES: CC(=O)NCCc1c[nH]c2c1cc(cc2)OC
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Indoles and derivatives
- Subclass: Indoles
- Class: Indoles and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name |
---|---|---|---|---|
P46597 | Download | Predicted | P46597_F1_nD2 P46597_F1_nD1 | Rossmann-like HTH |
4A6D | Predicted | e4a6dA2 e4a6dA1 | ||
4A6E | Predicted | e4a6eA4 e4a6eA3 |