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 |
|---|---|---|---|
| 2g8d | UMP | Thymidylate synthase |
| PDB ID | HET | Uniprot Name | EC Number | Cavity Similarity |
Align |
|---|---|---|---|---|---|
| 2g8d | UMP | Thymidylate synthase | / | 1.000 | |
| 2g8a | UMP | Thymidylate synthase | / | 0.748 | |
| 2g89 | UMP | Thymidylate synthase | / | 0.700 | |
| 1jmh | UMP | Thymidylate synthase | / | 0.651 | |
| 2g86 | UMP | Thymidylate synthase | / | 0.637 | |
| 1thy | UMP | Thymidylate synthase | / | 0.609 | |
| 1tsv | UMP | Thymidylate synthase | / | 0.608 | |
| 2tdd | THF | Thymidylate synthase | / | 0.604 | |
| 1njb | UMP | Thymidylate synthase | / | 0.602 | |
| 1njc | DCM | Thymidylate synthase | / | 0.596 | |
| 1bp6 | UMP | Thymidylate synthase | / | 0.594 | |
| 1nje | DCM | Thymidylate synthase | / | 0.592 | |
| 1bp0 | UMP | Thymidylate synthase | / | 0.578 | |
| 1nja | DCM | Thymidylate synthase | / | 0.578 | |
| 1tdc | UMP | Thymidylate synthase | / | 0.567 | |
| 1jmf | UMP | Thymidylate synthase | / | 0.563 | |
| 1bid | UMP | Thymidylate synthase | / | 0.555 | |
| 1jmg | UMP | Thymidylate synthase | / | 0.548 | |
| 1vza | UMP | Thymidylate synthase | / | 0.541 | |
| 2vf0 | F89 | Thymidylate synthase | / | 0.538 | |
| 2tdm | UMP | Thymidylate synthase | / | 0.537 | |
| 1njd | UMP | Thymidylate synthase | / | 0.536 | |
| 4ein | NOH | Thymidylate synthase | 2.1.1.45 | 0.522 | |
| 1jmi | UMP | Thymidylate synthase | / | 0.521 | |
| 4dpd | UMP | Bifunctional dihydrofolate reductase-thymidylate synthase | / | 0.519 | |
| 1vzd | CB3 | Thymidylate synthase | / | 0.516 | |
| 3dg8 | UMP | Bifunctional dihydrofolate reductase-thymidylate synthase | 1.5.1.3 | 0.512 | |
| 1bpj | UMP | Thymidylate synthase | / | 0.509 | |
| 3dga | UMP | Bifunctional dihydrofolate reductase-thymidylate synthase | 1.5.1.3 | 0.508 | |
| 3qj7 | UMP | Thymidylate synthase ThyA | / | 0.499 | |
| 2vet | UMP | Thymidylate synthase | / | 0.494 | |
| 4e5o | UMP | Thymidylate synthase | 2.1.1.45 | 0.494 | |
| 1tsx | UMP | Thymidylate synthase | / | 0.487 | |
| 1tlc | F89 | Thymidylate synthase | / | 0.483 | |
| 4h0u | UMP | Thymidylate synthase | / | 0.483 | |
| 1bdu | DUR | Thymidylate synthase | / | 0.479 | |
| 4dq1 | UMP | Thymidylate synthase | / | 0.474 | |
| 1f4e | TPR | Thymidylate synthase | / | 0.470 | |
| 4irr | UMP | Thymidylate synthase | / | 0.467 | |
| 1vzb | UMP | Thymidylate synthase | / | 0.465 | |
| 4eb4 | UMP | Thymidylate synthase | 2.1.1.45 | 0.465 | |
| 4fog | C2F | Thymidylate synthase ThyA | / | 0.463 | |
| 1f28 | UMP | Thymidylate synthase | 2.1.1.45 | 0.461 | |
| 4isk | UMP | Thymidylate synthase | / | 0.461 | |
| 2fto | TMP | Thymidylate synthase | / | 0.457 | |
| 1j3j | UMP | Bifunctional dihydrofolate reductase-thymidylate synthase | 1.5.1.3 | 0.453 | |
| 3bhr | THG | Thymidylate synthase | / | 0.451 | |
| 1aob | DDU | Thymidylate synthase | / | 0.445 | |
| 4ez8 | DHF | Thymidylate synthase | 2.1.1.45 | 0.445 | |
| 4xsd | UMP | Thymidylate synthase | 2.1.1.45 | 0.442 | |
| 3hb8 | UMP | Thymidylate synthase | 2.1.1.45 | 0.440 |