PDB ligand accession: SE2
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: MJKVTPMWOKAVMS-UHFFFAOYSA-N
SMILES: c1ccc2c(c1)C=C(C(=O)O2)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Phenylpropanoids and polyketides
- Class: Coumarins and derivatives
- Subclass: Hydroxycoumarins
- Class: Coumarins and derivatives
- Superclass: Phenylpropanoids and polyketides
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5Z1B | Download | Experimental | e5z1bA1 e5z1bA2 e5z1bB3 e5z1bA1 e5z1bA2 e5z1bB1 e5z1bB3 e5z1bC1 e5z1bC2 e5z1bD2 e5z1bC2 e5z1bD1 e5z1bD2 | TIM beta/alpha-barrel jelly-roll jelly-roll TIM beta/alpha-barrel jelly-roll TIM beta/alpha-barrel jelly-roll TIM beta/alpha-barrel jelly-roll jelly-roll jelly-roll TIM beta/alpha-barrel jelly-roll | LigPlot |