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 |
|---|---|---|---|
| 4dfr | MTX | Dihydrofolate reductase | 1.5.1.3 |
| PDB ID | HET | Uniprot Name | EC Number | Cavity Similarity |
Align |
|---|---|---|---|---|---|
| 4dfr | MTX | Dihydrofolate reductase | 1.5.1.3 | 1.000 | |
| 1dhj | MTX | Dihydrofolate reductase | 1.5.1.3 | 0.802 | |
| 2drc | MTX | Dihydrofolate reductase | 1.5.1.3 | 0.778 | |
| 1dra | MTX | Dihydrofolate reductase | 1.5.1.3 | 0.737 | |
| 1dyj | DDF | Dihydrofolate reductase | 1.5.1.3 | 0.701 | |
| 1jol | FFO | Dihydrofolate reductase | 1.5.1.3 | 0.689 | |
| 1dyh | DZF | Dihydrofolate reductase | 1.5.1.3 | 0.639 | |
| 1dyi | FOL | Dihydrofolate reductase | 1.5.1.3 | 0.630 | |
| 1ddr | MTX | Dihydrofolate reductase | 1.5.1.3 | 0.624 | |
| 1re7 | FOL | Dihydrofolate reductase | 1.5.1.3 | 0.567 | |
| 1dds | MTX | Dihydrofolate reductase | 1.5.1.3 | 0.553 | |
| 3och | 2MX | Dihydrofolate reductase | 1.5.1.3 | 0.553 | |
| 3drc | MTX | Dihydrofolate reductase | 1.5.1.3 | 0.550 | |
| 1rb3 | MTX | Dihydrofolate reductase | 1.5.1.3 | 0.545 | |
| 1rb2 | FOL | Dihydrofolate reductase | 1.5.1.3 | 0.526 | |
| 1drb | MTX | Dihydrofolate reductase | 1.5.1.3 | 0.522 | |
| 5hi6 | MTX | Dihydrofolate reductase | / | 0.519 | |
| 1tdr | MTX | Dihydrofolate reductase | 1.5.1.3 | 0.490 | |
| 4x5i | FOL | Dihydrofolate reductase | 1.5.1.3 | 0.476 | |
| 4x5j | FOL | Dihydrofolate reductase | 1.5.1.3 | 0.476 | |
| 1dhi | MTX | Dihydrofolate reductase | 1.5.1.3 | 0.471 | |
| 1rd7 | FOL | Dihydrofolate reductase | 1.5.1.3 | 0.460 | |
| 4cd2 | FOL | Dihydrofolate reductase | 1.5.1.3 | 0.458 | |
| 1ra3 | MTX | Dihydrofolate reductase | 1.5.1.3 | 0.456 |