PDB ligand accession: YXP
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: VMHLNIJHJPIPKG-POHAHGRESA-N
SMILES: COc1ccc(cc1)C=C2C(=O)N(C(=O)S2)CC(=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 |
---|---|---|---|---|---|
7MDS | Download | Experimental | e7mdsB1 e7mdsA1 | TIM beta/alpha-barrel TIM beta/alpha-barrel | LigPlot |