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 |
|---|---|---|---|
| 3lak | KR1 | Gag-Pol polyprotein | 2.7.7.49 |
| PDB ID | HET | Uniprot Name | EC Number | Cavity Similarity |
Align |
|---|---|---|---|---|---|
| 3lak | KR1 | Gag-Pol polyprotein | 2.7.7.49 | 1.000 | |
| 3drp | R8E | Gag-Pol polyprotein | 2.7.7.49 | 0.604 | |
| 3t1a | 5MA | Gag-Pol polyprotein | 2.7.7.49 | 0.597 | |
| 3lal | KRV | Gag-Pol polyprotein | 2.7.7.49 | 0.595 | |
| 3c6u | M22 | Gag-Pol polyprotein | 2.7.7.49 | 0.583 | |
| 3dya | PZL | Gag-Pol polyprotein | 2.7.7.49 | 0.583 | |
| 3c6t | M14 | Gag-Pol polyprotein | 2.7.7.49 | 0.581 | |
| 3t19 | 5MA | Gag-Pol polyprotein | 2.7.7.49 | 0.577 | |
| 3tam | M06 | Gag-Pol polyprotein | 2.7.7.49 | 0.571 | |
| 4h4m | 494 | Gag-Pol polyprotein | 2.7.7.49 | 0.560 | |
| 2be2 | R22 | Gag-Pol polyprotein | 2.7.7.49 | 0.559 | |
| 3dmj | GWE | Pol protein | / | 0.554 | |
| 4rw4 | 494 | Gag-Pol polyprotein | 2.7.7.49 | 0.551 | |
| 3dok | GWJ | Pol protein | / | 0.550 | |
| 4h4o | 506 | Gag-Pol polyprotein | 2.7.7.49 | 0.550 | |
| 3drr | R8E | Gag-Pol polyprotein | 2.7.7.49 | 0.546 | |
| 2won | ZZE | Gag-Pol polyprotein | 2.7.7.49 | 0.531 | |
| 4rw6 | 494 | Gag-Pol polyprotein | 2.7.7.49 | 0.530 | |
| 3lam | KRP | Gag-Pol polyprotein | 2.7.7.49 | 0.527 | |
| 4mfb | 29T | Gag-Pol polyprotein | 2.7.7.49 | 0.522 | |
| 2ynh | EUR | Gag-Pol polyprotein | 2.7.7.49 | 0.517 | |
| 2ynf | WHU | Gag-Pol polyprotein | 2.7.7.49 | 0.515 | |
| 3lan | KBT | Gag-Pol polyprotein | 2.7.7.49 | 0.506 | |
| 2b5j | 3AC | Gag-Pol polyprotein | 2.7.7.49 | 0.503 | |
| 3dol | GWI | Pol protein | / | 0.500 | |
| 3dlg | GWE | Gag-Pol polyprotein | 2.7.7.49 | 0.492 | |
| 3di6 | PDZ | Gag-Pol polyprotein | 2.7.7.49 | 0.482 | |
| 3dle | GFA | Gag-Pol polyprotein | 2.7.7.49 | 0.481 | |
| 1rt1 | MKC | Gag-Pol polyprotein | 2.7.7.49 | 0.479 | |
| 1jla | TNK | Gag-Pol polyprotein | 2.7.7.49 | 0.474 | |
| 1c1c | 612 | Gag-Pol polyprotein | 2.7.7.49 | 0.469 | |
| 3e01 | PZ2 | Gag-Pol polyprotein | 2.7.7.49 | 0.468 | |
| 1ep4 | S11 | Gag-Pol polyprotein | 2.7.7.49 | 0.461 | |
| 4jib | 1L6 | cGMP-dependent 3',5'-cyclic phosphodiesterase | 3.1.4.17 | 0.460 | |
| 5ai5 | BSU | Bifunctional epoxide hydrolase 2 | 3.1.3.76 | 0.452 | |
| 3qlh | T27 | Gag-Pol polyprotein | 2.7.7.49 | 0.450 | |
| 4i2p | G73 | Gag-Pol polyprotein | 2.7.7.49 | 0.449 | |
| 4id5 | T27 | Gag-Pol polyprotein | 2.7.7.49 | 0.446 | |
| 4wa9 | AXI | Tyrosine-protein kinase ABL1 | 2.7.10.2 | 0.444 | |
| 1s1v | TNK | Gag-Pol polyprotein | 2.7.7.49 | 0.443 | |
| 3bgr | T27 | Gag-Pol polyprotein | 2.7.7.49 | 0.443 | |
| 2zd1 | T27 | Gag-Pol polyprotein | 2.7.7.49 | 0.442 | |
| 3nr4 | PYV | Abscisic acid receptor PYL2 | / | 0.440 |