PDB ligand accession: DIO
DrugBank: DB03316
PubChem:
ChEMBL:
InChI Key: RYHBNJHYFVUHQT-UHFFFAOYSA-N
SMILES: C1COCCO1
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Dioxanes
- Subclass: 1,4-dioxanes
- Class: Dioxanes
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3VAI | Download | Experimental | e3vaiA1 e3vaiA2 e3vaiB2 | Alpha-beta plaits Alpha-beta plaits Alpha-beta plaits | LigPlot |
3VAL | Download | Experimental | e3valA1 e3valA2 e3valB1 e3valD1 e3valD2 e3valI1 | Alpha-beta plaits Alpha-beta plaits Alpha-beta plaits Alpha-beta plaits Alpha-beta plaits Alpha-beta plaits | LigPlot |
4TU8 | Download | Experimental | e4tu8A1 e4tu8A2 e4tu8B1 e4tu8B2 | Alpha-beta plaits Alpha-beta plaits Alpha-beta plaits Alpha-beta plaits | LigPlot |
2G4B | Download | Experimental | e2g4bA2 | Alpha-beta plaits | LigPlot |
4TU9 | Download | Experimental | e4tu9A2 e4tu9B2 | Alpha-beta plaits Alpha-beta plaits | LigPlot |
3VAJ | Download | Experimental | e3vajA1 e3vajA2 e3vajB2 | Alpha-beta plaits Alpha-beta plaits Alpha-beta plaits | LigPlot |
3VAF | Download | Experimental | e3vafA3 e3vafA4 e3vafB1 | Alpha-beta plaits Alpha-beta plaits Alpha-beta plaits | LigPlot |
5EV2 | Download | Experimental | e5ev2A1 e5ev2A2 | Alpha-beta plaits Alpha-beta plaits | LigPlot |
3VAG | Download | Experimental | e3vagA1 e3vagB2 | Alpha-beta plaits Alpha-beta plaits | LigPlot |
4TU7 | Download | Experimental | e4tu7A1 e4tu7A2 e4tu7B1 | Alpha-beta plaits Alpha-beta plaits Alpha-beta plaits | LigPlot |
3VAH | Download | Experimental | e3vahA1 e3vahA2 e3vahB2 | Alpha-beta plaits Alpha-beta plaits Alpha-beta plaits | LigPlot |
3VAM | Download | Experimental | e3vamA1 e3vamA2 e3vamB2 | Alpha-beta plaits Alpha-beta plaits Alpha-beta plaits | LigPlot |
3VAK | Download | Experimental | e3vakA1 e3vakA2 e3vakB2 | Alpha-beta plaits Alpha-beta plaits Alpha-beta plaits | LigPlot |