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 |
|---|---|---|---|
| 2pul | ACP | Methylthioribose kinase | 2.7.1.100 |
| PDB ID | HET | Uniprot Name | EC Number | Cavity Similarity |
Align |
|---|---|---|---|---|---|
| 2pul | ACP | Methylthioribose kinase | 2.7.1.100 | 1.000 | |
| 2pun | ACP | Methylthioribose kinase | 2.7.1.100 | 0.607 | |
| 2olc | ADP | Methylthioribose kinase | 2.7.1.100 | 0.581 | |
| 2pup | ADP | Methylthioribose kinase | 2.7.1.100 | 0.551 | |
| 2pui | ADP | Methylthioribose kinase | 2.7.1.100 | 0.549 | |
| 3igo | ANP | Calmodulin-domain protein kinase 1, putative | / | 0.467 | |
| 4icy | FAD | PgaE | / | 0.461 | |
| 3qlx | QLR | Uncharacterized protein | / | 0.457 | |
| 4ydu | ADP | tRNA N6-adenosine threonylcarbamoyltransferase | / | 0.456 | |
| 2hxl | 422 | Serine/threonine-protein kinase Chk1 | 2.7.11.1 | 0.455 | |
| 3nrr | D16 | Bifunctional dihydrofolate reductase-thymidylate synthase | / | 0.450 | |
| 2pr2 | DG1 | Enoyl-[acyl-carrier-protein] reductase [NADH] | 1.3.1.9 | 0.448 | |
| 3eej | 53R | Uncharacterized protein | / | 0.447 | |
| 4jia | 1K3 | Tyrosine-protein kinase JAK2 | / | 0.447 | |
| 2j9g | ANP | Biotin carboxylase | 6.3.4.14 | 0.446 | |
| 1wvx | BD4 | Death-associated protein kinase 1 | 2.7.11.1 | 0.445 | |
| 4xx9 | ATP | 3-phosphoinositide-dependent protein kinase 1 | 2.7.11.1 | 0.445 | |
| 2etm | 7PY | Focal adhesion kinase 1 | 2.7.10.2 | 0.444 | |
| 3we4 | 5FI | Ribosomal protein S6 kinase beta-1 | 2.7.11.1 | 0.444 | |
| 5auw | QUE | Death-associated protein kinase 1 | 2.7.11.1 | 0.441 | |
| 1e7v | LY2 | Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform | 2.7.1.153 | 0.440 | |
| 3a99 | ANP | Serine/threonine-protein kinase pim-1 | 2.7.11.1 | 0.440 | |
| 4fob | 0US | ALK tyrosine kinase receptor | 2.7.10.1 | 0.440 | |
| 4l3l | 5FI | Ribosomal protein S6 kinase beta-1 | 2.7.11.1 | 0.440 | |
| 4qml | ANP | Serine/threonine-protein kinase 24 | 2.7.11.1 | 0.440 |