PDB ligand accession: BTN
DrugBank: DB00121
PubChem:
ChEMBL:
InChI Key: YBJHBAHKTGYVGT-ZKWXMUAHSA-N
SMILES: C1C2C(C(S1)CCCCC(=O)O)NC(=O)N2
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Biotin and derivatives
- Subclass: None
- Class: Biotin and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
7ZZ1 | Download | Experimental | e7zz1A1 e7zz1A2 e7zz1B1 | TIM beta/alpha-barrel RuvA-C alpha/beta-Hammerhead/Barrel-sandwich hybrid | LigPlot |
7ZZ3 | Download | Experimental | e7zz3A1 e7zz3A5 e7zz3A7 e7zz3A8 | Rossmann-like alpha/beta-Hammerhead/Barrel-sandwich hybrid Protein kinase/SAICAR synthase/ATP-grasp alpha/beta-Hammerhead/Barrel-sandwich hybrid | LigPlot |