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 |
|---|---|---|---|
| 2fto | TMP | Thymidylate synthase |
| PDB ID | HET | Uniprot Name | EC Number | Cavity Similarity |
Align |
|---|---|---|---|---|---|
| 2fto | TMP | Thymidylate synthase | / | 1.000 | |
| 2fto | CB3 | Thymidylate synthase | / | 0.882 | |
| 3bhr | THG | Thymidylate synthase | / | 0.605 | |
| 3bgx | TMP | Thymidylate synthase | / | 0.587 | |
| 3bgx | MEF | Thymidylate synthase | / | 0.581 | |
| 1tys | DHF | Thymidylate synthase | / | 0.566 | |
| 1tys | TMP | Thymidylate synthase | / | 0.555 | |
| 4knz | CB3 | Thymidylate synthase | / | 0.555 | |
| 4ez8 | DHF | Thymidylate synthase | 2.1.1.45 | 0.547 | |
| 1tdu | DUR | Thymidylate synthase | / | 0.546 | |
| 1fwm | CB3 | Thymidylate synthase | / | 0.545 | |
| 1tdu | CB3 | Thymidylate synthase | / | 0.543 | |
| 3bhl | THG | Thymidylate synthase | / | 0.534 | |
| 4isk | UMP | Thymidylate synthase | / | 0.534 | |
| 4gev | CB3 | Thymidylate synthase | / | 0.530 | |
| 1ddu | CB3 | Thymidylate synthase | / | 0.516 | |
| 1ddu | DDU | Thymidylate synthase | / | 0.514 | |
| 4fog | C2F | Thymidylate synthase ThyA | / | 0.514 | |
| 2vf0 | F89 | Thymidylate synthase | / | 0.511 | |
| 1f4f | TP3 | Thymidylate synthase | / | 0.501 | |
| 4o7u | THF | Thymidylate synthase | / | 0.489 | |
| 4ein | NOH | Thymidylate synthase | 2.1.1.45 | 0.482 | |
| 1f28 | UMP | Thymidylate synthase | 2.1.1.45 | 0.476 | |
| 1an5 | CB3 | Thymidylate synthase | / | 0.475 | |
| 4eil | UMP | Bifunctional dihydrofolate reductase-thymidylate synthase | 1.5.1.3 | 0.470 | |
| 4fox | UMP | Thymidylate synthase ThyA | / | 0.469 | |
| 1f4g | TP4 | Thymidylate synthase | / | 0.464 | |
| 1njb | UMP | Thymidylate synthase | / | 0.452 | |
| 2g89 | UMP | Thymidylate synthase | / | 0.449 |