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 |
|---|---|---|---|
| 4pgt | GBX | Glutathione S-transferase P | 2.5.1.18 |
| PDB ID | HET | Uniprot Name | EC Number | Cavity Similarity |
Align |
|---|---|---|---|---|---|
| 4pgt | GBX | Glutathione S-transferase P | 2.5.1.18 | 1.000 | |
| 3pgt | GBX | Glutathione S-transferase P | 2.5.1.18 | 0.536 | |
| 17gs | GTX | Glutathione S-transferase P | 2.5.1.18 | 0.532 | |
| 12gs | 0HH | Glutathione S-transferase P | 2.5.1.18 | 0.529 | |
| 1gti | GTB | Glutathione S-transferase P 1 | 2.5.1.18 | 0.516 | |
| 13gs | SAS | Glutathione S-transferase P | 2.5.1.18 | 0.505 | |
| 20gs | CBD | Glutathione S-transferase P | 2.5.1.18 | 0.498 | |
| 1pgt | GTX | Glutathione S-transferase P | 2.5.1.18 | 0.459 | |
| 1gss | LEE | Glutathione S-transferase P | 2.5.1.18 | 0.449 |