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 |
|---|---|---|---|
| 3och | 2MX | Dihydrofolate reductase | 1.5.1.3 |
| PDB ID | HET | Uniprot Name | EC Number | Cavity Similarity |
Align |
|---|---|---|---|---|---|
| 3och | 2MX | Dihydrofolate reductase | 1.5.1.3 | 1.000 | |
| 1dds | MTX | Dihydrofolate reductase | 1.5.1.3 | 0.614 | |
| 1dhj | MTX | Dihydrofolate reductase | 1.5.1.3 | 0.611 | |
| 1dra | MTX | Dihydrofolate reductase | 1.5.1.3 | 0.586 | |
| 1jol | FFO | Dihydrofolate reductase | 1.5.1.3 | 0.586 | |
| 1dyj | DDF | Dihydrofolate reductase | 1.5.1.3 | 0.584 | |
| 4dfr | MTX | Dihydrofolate reductase | 1.5.1.3 | 0.581 | |
| 3drc | MTX | Dihydrofolate reductase | 1.5.1.3 | 0.576 | |
| 1ddr | MTX | Dihydrofolate reductase | 1.5.1.3 | 0.575 | |
| 2drc | MTX | Dihydrofolate reductase | 1.5.1.3 | 0.572 | |
| 1tdr | MTX | Dihydrofolate reductase | 1.5.1.3 | 0.557 | |
| 1re7 | FOL | Dihydrofolate reductase | 1.5.1.3 | 0.540 | |
| 1drb | MTX | Dihydrofolate reductase | 1.5.1.3 | 0.531 | |
| 1dyi | FOL | Dihydrofolate reductase | 1.5.1.3 | 0.524 | |
| 1rb3 | MTX | Dihydrofolate reductase | 1.5.1.3 | 0.514 | |
| 1dhi | MTX | Dihydrofolate reductase | 1.5.1.3 | 0.499 | |
| 2w9s | TOP | Dihydrofolate reductase type 1 from Tn4003 | 1.5.1.3 | 0.488 | |
| 1dyh | DZF | Dihydrofolate reductase | 1.5.1.3 | 0.482 | |
| 1rf7 | DHF | Dihydrofolate reductase | 1.5.1.3 | 0.473 | |
| 1rb2 | FOL | Dihydrofolate reductase | 1.5.1.3 | 0.466 | |
| 4cd2 | FOL | Dihydrofolate reductase | 1.5.1.3 | 0.464 | |
| 1rd7 | FOL | Dihydrofolate reductase | 1.5.1.3 | 0.451 | |
| 2qk8 | MTX | Dihydrofolate reductase | / | 0.445 | |
| 4ele | 31I | Dihydrofolate reductase | / | 0.444 | |
| 1diu | BDM | Dihydrofolate reductase | 1.5.1.3 | 0.441 | |
| 3clb | NAP | Bifunctional dihydrofolate reductase-thymidylate synthase | 1.5.1.3 | 0.441 |