PDB ligand accession: 33W
DrugBank: n/a
PubChem: 2761814;7016819;
ChEMBL: n/a
InChI Key: LKORPMMOJAJYLC-YFKPBYRVSA-N
SMILES: c1cc(sc1CC(C(=O)O)N)Br
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 |
---|---|---|---|---|---|
4TQF | Download | Experimental | e4tqfA1 | Class II aaRS and biotin synthetases | LigPlot |