PDB ligand accession: IBP
DrugBank: DB09213
PubChem:
ChEMBL:
InChI Key: HEFNNWSXXWATRW-JTQLQIEISA-N
SMILES: CC(C)Cc1ccc(cc1)C(C)C(=O)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Phenylpropanoids and polyketides
- Class: Phenylpropanoic acids
- Subclass: None
- Class: Phenylpropanoic acids
- Superclass: Phenylpropanoids and polyketides
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3IB2 | Download | Experimental | e3ib2A1 e3ib2A2 | Periplasmic binding protein-like II Periplasmic binding protein-like II | LigPlot |