PDB ligand accession: EDO
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: LYCAIKOWRPUZTN-UHFFFAOYSA-N
SMILES: C(CO)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic oxygen compounds
- Class: Organooxygen compounds
- Subclass: Alcohols and polyols
- Class: Organooxygen compounds
- Superclass: Organic oxygen compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
2G50 | Download | Experimental | e2g50C4 e2g50C2 e2g50A2 e2g50B4 e2g50B3 e2g50C2 e2g50A2 e2g50A1 e2g50D4 e2g50E2 e2g50H4 e2g50F1 e2g50H2 e2g50G1 e2g50H2 | cradle loop barrel TIM beta/alpha-barrel TIM beta/alpha-barrel cradle loop barrel TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel cradle loop barrel cradle loop barrel TIM beta/alpha-barrel cradle loop barrel TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel | LigPlot |
8F5U | Download | Experimental | e8f5uA1 e8f5uB1 e8f5uB2 | TIM beta/alpha-barrel cradle loop barrel TIM beta/alpha-barrel | LigPlot |
3N25 | Download | Experimental | e3n25C1 e3n25A1 e3n25C2 e3n25B1 e3n25B3 e3n25C2 e3n25D4 e3n25D3 e3n25E3 e3n25F3 e3n25H3 | cradle loop barrel TIM beta/alpha-barrel TIM beta/alpha-barrel cradle loop barrel TIM beta/alpha-barrel TIM beta/alpha-barrel cradle loop barrel TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel | LigPlot |