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 |
|---|---|---|---|---|---|
| 7ZZP | Download | Experimental | e7zzpA1 e7zzpB1 | HAD domain-related HAD domain-related | LigPlot |
| 7ZZU | Download | Experimental | e7zzuB1 e7zzuA1 | HAD domain-related HAD domain-related | LigPlot |
| 7ZZR | Download | Experimental | e7zzrA1 e7zzrB1 | HAD domain-related HAD domain-related | LigPlot |
| 6WHQ | Download | Experimental | e6whqA1 | HAD domain-related | LigPlot |
| 4LXZ | Download | Experimental | e4lxzB1 | HAD domain-related | LigPlot |
| 3MAX | Download | Experimental | e3maxA1 | HAD domain-related | LigPlot |
| 6WHO | Download | Experimental | e6whoA1 | HAD domain-related | LigPlot |
| 6WI3 | Download | Experimental | e6wi3A1 | HAD domain-related | LigPlot |
| 6WHN | Download | Experimental | e6whnA1 e6whnA1 e6whnB1 | HAD domain-related HAD domain-related HAD domain-related | LigPlot |
| 7ZZT | Download | Experimental | e7zztA1 e7zztB1 | HAD domain-related HAD domain-related | LigPlot |
| 4LY1 | Download | Experimental | e4ly1B1 | HAD domain-related | LigPlot |
| 8A0B | Download | Experimental | e8a0bA1 e8a0bB1 | HAD domain-related HAD domain-related | LigPlot |