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 |
|---|---|---|---|
| 2bfm | TOP | Pteridine reductase 1 | 1.5.1.33 |
| PDB ID | HET | Uniprot Name | EC Number | Cavity Similarity |
Align |
|---|---|---|---|---|---|
| 2bfm | TOP | Pteridine reductase 1 | 1.5.1.33 | 1.000 | |
| 2bfp | H4B | Pteridine reductase 1 | 1.5.1.33 | 0.573 | |
| 2bf7 | HBI | Pteridine reductase 1 | 1.5.1.33 | 0.571 | |
| 1e92 | HBI | Pteridine reductase 1 | 1.5.1.33 | 0.565 | |
| 3h4v | DVP | Pteridine reductase 1 | 1.5.1.33 | 0.554 | |
| 1p33 | MTX | Pteridine reductase 1 | 1.5.1.33 | 0.491 | |
| 2bfa | CB3 | Pteridine reductase 1 | 1.5.1.33 | 0.482 | |
| 2qhx | FE1 | Pteridine reductase 1 | 1.5.1.33 | 0.473 | |
| 1mxf | MTX | Putative pteridine reductase 2 | / | 0.459 | |
| 2vz0 | D64 | Pteridine reductase | / | 0.457 | |
| 3bmn | AX3 | Pteridine reductase | / | 0.455 | |
| 3jq8 | DX3 | Pteridine reductase, putative | / | 0.444 | |
| 3h4v | NAP | Pteridine reductase 1 | 1.5.1.33 | 0.440 |