PDB ligand accession: CPS
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: UMCMPZBLKLEWAF-BCTGSCMUSA-N
SMILES: CC(CCC(=O)NCCC[N+](C)(C)CCCS(=O)(=O)[O-])C1CCC2C1(C(CC3C2C(CC4C3(CCC(C4)O)C)O)O)C
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Lipids and lipid-like molecules
- Class: Steroids and steroid derivatives
- Subclass: Bile acids, alcohols and derivatives
- Class: Steroids and steroid derivatives
- Superclass: Lipids and lipid-like molecules
| PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
|---|---|---|---|---|---|
| 5FF0 | Download | Experimental | e5ff0A1 | TIM beta/alpha-barrel | LigPlot |
| 7O1T | Download | Experimental | e7o1tA1 | TIM beta/alpha-barrel | LigPlot |
| 8QMM | Download | Experimental | e8qmmA1 | TIM beta/alpha-barrel | LigPlot |
| 8QMN | Download | Experimental | e8qmnA1 | TIM beta/alpha-barrel | LigPlot |
| 3IIZ | Download | Experimental | e3iizA1 | TIM beta/alpha-barrel | LigPlot |
| 7O1P | Download | Experimental | e7o1pA1 | TIM beta/alpha-barrel | LigPlot |
| 7O26 | Download | Experimental | e7o26A1 | TIM beta/alpha-barrel | LigPlot |
| 5FF3 | Download | Experimental | e5ff3A1 | TIM beta/alpha-barrel | LigPlot |
| 5FF4 | Download | Experimental | e5ff4A1 | TIM beta/alpha-barrel | LigPlot |
| 3CIW | Download | Experimental | e3ciwA1 | TIM beta/alpha-barrel | LigPlot |
| 5FEX | Download | Experimental | e5fexA1 | TIM beta/alpha-barrel | LigPlot |
| 8QMK | Download | Experimental | e8qmkA1 | TIM beta/alpha-barrel | LigPlot |
| 4JYD | Download | Experimental | e4jydA1 | TIM beta/alpha-barrel | LigPlot |
| 5FEP | Download | Experimental | e5fepA1 | TIM beta/alpha-barrel | LigPlot |
| 3IIX | Download | Experimental | e3iixA1 | TIM beta/alpha-barrel | LigPlot |
| 5FEW | Download | Experimental | e5fewA1 | TIM beta/alpha-barrel | LigPlot |
| 3CIX | Download | Experimental | e3cixA1 | TIM beta/alpha-barrel | LigPlot |
| 7O1S | Download | Experimental | e7o1sA1 | TIM beta/alpha-barrel | LigPlot |
| 5FES | Download | Experimental | e5fesA1 | TIM beta/alpha-barrel | LigPlot |
| 8QML | Download | Experimental | e8qmlA1 | TIM beta/alpha-barrel | LigPlot |
| 5FEZ | Download | Experimental | e5fezA1 | TIM beta/alpha-barrel | LigPlot |
| 7O25 | Download | Experimental | e7o25A1 | TIM beta/alpha-barrel | LigPlot |
| 5FF2 | Download | Experimental | e5ff2A1 | TIM beta/alpha-barrel | LigPlot |