PDB ligand accession: 3IO
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: RSTKLPZEZYGQPY-UHFFFAOYSA-N
SMILES: c1ccc2c(c1)c(c[nH]2)CC(=O)C(=O)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Indoles and derivatives
- Subclass: Indolyl carboxylic acids and derivatives
- Class: Indoles and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
1XES | Download | Experimental | e1xesA1 e1xesA2 e1xesB1 e1xesA1 e1xesB1 e1xesB2 e1xesC1 e1xesC2 e1xesD1 e1xesC1 e1xesD1 e1xesD2 | Thiolase-like Thiolase-like Thiolase-like Thiolase-like Thiolase-like Thiolase-like Thiolase-like Thiolase-like Thiolase-like Thiolase-like Thiolase-like Thiolase-like | LigPlot |
1XET | Download | Experimental | e1xetA1 e1xetB1 e1xetB2 e1xetC1 e1xetC2 e1xetD1 e1xetC1 e1xetD1 e1xetD2 | Thiolase-like Thiolase-like Thiolase-like Thiolase-like Thiolase-like Thiolase-like Thiolase-like Thiolase-like Thiolase-like | LigPlot |