PDB ligand accession: NHE
DrugBank: DB03309
PubChem: 66898;3852474;
ChEMBL: n/a
InChI Key: MKWKNSIESPFAQN-UHFFFAOYSA-N
SMILES: C1CCC(CC1)NCCS(=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 |
|---|---|---|---|---|---|
| 5P9B | Download | Experimental | e5p9bA1 | Rossmann-like | LigPlot |
| 5P8Y | Download | Experimental | e5p8yA1 | Rossmann-like | LigPlot |
| 5P91 | Download | Experimental | e5p91A1 | Rossmann-like | LigPlot |
| 5LR6 | Download | Experimental | e5lr6A1 e5lr6C1 e5lr6B1 e5lr6D1 | Rossmann-like Rossmann-like Rossmann-like Rossmann-like | LigPlot |
| 5P9N | Download | Experimental | e5p9nA1 | Rossmann-like | LigPlot |
| 5P96 | Download | Experimental | e5p96A1 | Rossmann-like | LigPlot |
| 5P95 | Download | Experimental | e5p95A1 | Rossmann-like | LigPlot |
| 5LQA | Download | Experimental | e5lqaA1 | Rossmann-like | LigPlot |
| 5P93 | Download | Experimental | e5p93A1 | Rossmann-like | LigPlot |
| 5K0N | Download | Experimental | e5k0nA1 e5k0nC1 e5k0nB1 e5k0nD1 | Rossmann-like Rossmann-like Rossmann-like Rossmann-like | LigPlot |
| 5P9O | Download | Experimental | e5p9oA1 | Rossmann-like | LigPlot |
| 5P9T | Download | Experimental | e5p9tA1 | Rossmann-like | LigPlot |
| 5LQK | Download | Experimental | e5lqkA1 | Rossmann-like | LigPlot |
| 3HVK | Download | Experimental | e3hvkA1 | Rossmann-like | LigPlot |
| 3R6T | Download | Experimental | e3r6tA1 | Rossmann-like | LigPlot |
| 5P97 | Download | Experimental | e5p97A1 | Rossmann-like | LigPlot |
| 5P94 | Download | Experimental | e5p94A1 | Rossmann-like | LigPlot |
| 3NW9 | Download | Experimental | e3nw9A1 | Rossmann-like | LigPlot |
| 5P90 | Download | Experimental | e5p90A1 | Rossmann-like | LigPlot |
| 5LQR | Download | Experimental | e5lqrA1 | Rossmann-like | LigPlot |
| 5K0L | Download | Experimental | e5k0lA1 e5k0lC1 e5k0lB1 e5k0lD1 | Rossmann-like Rossmann-like Rossmann-like Rossmann-like | LigPlot |
| 5P99 | Download | Experimental | e5p99A1 | Rossmann-like | LigPlot |
| 5PA2 | Download | Experimental | e5pa2A1 | Rossmann-like | LigPlot |
| 3NWE | Download | Experimental | e3nweA1 | Rossmann-like | LigPlot |
| 5P9P | Download | Experimental | e5p9pA1 | Rossmann-like | LigPlot |
| 5P8Z | Download | Experimental | e5p8zA1 | Rossmann-like | LigPlot |
| 5P8X | Download | Experimental | e5p8xA1 | Rossmann-like | LigPlot |
| 5K0C | Download | Experimental | e5k0cA1 e5k0cB1 | Rossmann-like Rossmann-like | LigPlot |
| 5P98 | Download | Experimental | e5p98A1 | Rossmann-like | LigPlot |
| 5PA1 | Download | Experimental | e5pa1A1 | Rossmann-like | LigPlot |
| 5P9Y | Download | Experimental | e5p9yA1 | Rossmann-like | LigPlot |
| 5K0J | Download | Experimental | e5k0jA1 e5k0jB1 | Rossmann-like Rossmann-like | LigPlot |
| 5PA6 | Download | Experimental | e5pa6A1 | Rossmann-like | LigPlot |
| 5P9X | Download | Experimental | e5p9xA1 | Rossmann-like | LigPlot |
| 3NWB | Download | Experimental | e3nwbA1 | Rossmann-like | LigPlot |
| 5K0F | Download | Experimental | e5k0fA1 e5k0fB1 | Rossmann-like Rossmann-like | LigPlot |
| 5K0E | Download | Experimental | e5k0eA1 | Rossmann-like | LigPlot |
| 5P92 | Download | Experimental | e5p92A1 | Rossmann-like | LigPlot |
| 5P9W | Download | Experimental | e5p9wA1 | Rossmann-like | LigPlot |
| 5K0G | Download | Experimental | e5k0gA1 e5k0gB1 | Rossmann-like Rossmann-like | LigPlot |