Cavities are compared using Shaper.
For more information, please see the following publication:
Desaphy J. et al. Comparison and Druggability Prediction of protein-Ligand Binding sites from pharmacophore-annotated cavity shapes J. Chem. Inf. Model., 2012, 52(8), pp2287-2299
| PDB ID | HET | Uniprot Name | EC Number |
|---|---|---|---|
| 4dc0 | NDP | Putative ketoacyl reductase | 1.3.1 |
| PDB ID | HET | Uniprot Name | EC Number | Cavity Similarity |
Align |
|---|---|---|---|---|---|
| 4dc0 | NDP | Putative ketoacyl reductase | 1.3.1 | 1.000 | |
| 1x7h | NDP | Putative ketoacyl reductase | 1.3.1 | 0.504 | |
| 1x7g | NAP | Putative ketoacyl reductase | 1.3.1 | 0.492 | |
| 4dbz | NDP | Putative ketoacyl reductase | 1.3.1 | 0.492 | |
| 1w4z | NAP | Putative ketoacyl reductase | 1.3.1 | 0.480 | |
| 3sju | NDP | Keto reductase | / | 0.464 |