PDB ligand accession: MPD
DrugBank: DB03564
PubChem:
ChEMBL: n/a
InChI Key: SVTBMSDMJJWYQN-YFKPBYRVSA-N
SMILES: CC(CC(C)(C)O)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 |
|---|---|---|---|---|---|
| 7JQA | Download | Experimental | e7jqaC2 | Rossmann-like | LigPlot |
| 8G4V | Download | Experimental | e8g4vA2 | Rossmann-like | LigPlot |
| 1MGO | Download | Experimental | e1mgoB1 e1mgoB2 | GroES-like Rossmann-like | LigPlot |
| 8G2X | Download | Experimental | e8g2xA1 e8g2xA2 | Rossmann-like GroES-like | LigPlot |
| 1P1R | Download | Experimental | e1p1rB2 | Rossmann-like | LigPlot |
| 6CXX | Download | Experimental | e6cxxA2 | Rossmann-like | LigPlot |
| 8G2L | Download | Experimental | e8g2lA1 | Rossmann-like | LigPlot |
| 5ADH | Download | Experimental | e5adhA1 e5adhA2 | GroES-like Rossmann-like | LigPlot |
| 8G2S | Download | Experimental | e8g2sA2 | Rossmann-like | LigPlot |
| 8G41 | Download | Experimental | e8g41A1 e8g41A1 e8g41B1 e8g41B2 | Rossmann-like Rossmann-like Rossmann-like GroES-like | LigPlot |
| 1N92 | Download | Experimental | e1n92A2 | Rossmann-like | LigPlot |
| 1QV6 | Download | Experimental | e1qv6A2 | Rossmann-like | LigPlot |
| 1N8K | Download | Experimental | e1n8kA2 | Rossmann-like | LigPlot |
| 1YE3 | Download | Experimental | e1ye3A1 e1ye3A2 | GroES-like Rossmann-like | LigPlot |