PDB ligand accession: CXS
DrugBank: DB02219
PubChem: 70815;12546061;
ChEMBL: n/a
InChI Key: PJWWRFATQTVXHA-UHFFFAOYSA-N
SMILES: C1CCC(CC1)NCCCS(=O)(=O)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic nitrogen compounds
- Class: Organonitrogen compounds
- Subclass: Cyclohexylamines
- Class: Organonitrogen compounds
- Superclass: Organic nitrogen compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5K0B | Download | Experimental | e5k0bA1 e5k0bC1 e5k0bD1 e5k0bA1 e5k0bD1 e5k0bA1 e5k0bB1 e5k0bE1 e5k0bF1 e5k0bB1 e5k0bH1 | Rossmann-like Rossmann-like Rossmann-like Rossmann-like Rossmann-like Rossmann-like Rossmann-like Rossmann-like Rossmann-like Rossmann-like Rossmann-like | LigPlot |
3HVH | Download | Experimental | e3hvhA1 | Rossmann-like | LigPlot |
5P9V | Download | Experimental | e5p9vA1 | Rossmann-like | LigPlot |
5PA0 | Download | Experimental | e5pa0A1 | Rossmann-like | LigPlot |