PDB ligand accession: MCG
DrugBank: DB04256
PubChem: 446355;139055582;
ChEMBL:
InChI Key: DNCAZYRLRMTVSF-JTQLQIEISA-N
SMILES: CC(c1ccc(cc1)C(=O)O)(C(=O)O)N
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 |
---|---|---|---|---|---|
1ISS | Download | Experimental | e1issA2 e1issA3 e1issB2 e1issB3 | Flavodoxin-like Flavodoxin-like Flavodoxin-like Flavodoxin-like | LigPlot |