PDB ligand accession: EG6
DrugBank: n/a
PubChem: n/a
ChEMBL: n/a
InChI Key: YJGBVICLINVYSP-UHFFFAOYSA-N
SMILES: Cc1c(sc(n1)c2ccc(cc2)C(F)(F)F)C(=O)NC(CO)C(=O)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic acids and derivatives
- Class: Carboxylic acids and derivatives
- Subclass: Amino acids, peptides, and analogues
- Class: Carboxylic acids and derivatives
- Superclass: Organic acids and derivatives
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4WEY | Download | Experimental | e4weyA2 e4weyB1 e4weyB2 | Thioredoxin-like Insertion subdomain in DsbA-like Thioredoxin-like | LigPlot |