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 |
|---|---|---|---|
| 2be2 | R22 | Gag-Pol polyprotein | 2.7.7.49 |
| PDB ID | HET | Uniprot Name | EC Number | Cavity Similarity |
Align |
|---|---|---|---|---|---|
| 2be2 | R22 | Gag-Pol polyprotein | 2.7.7.49 | 1.000 | |
| 4h4o | 506 | Gag-Pol polyprotein | 2.7.7.49 | 0.564 | |
| 2b5j | 3AC | Gag-Pol polyprotein | 2.7.7.49 | 0.555 | |
| 3c6t | M14 | Gag-Pol polyprotein | 2.7.7.49 | 0.553 | |
| 3c6u | M22 | Gag-Pol polyprotein | 2.7.7.49 | 0.552 | |
| 3drp | R8E | Gag-Pol polyprotein | 2.7.7.49 | 0.551 | |
| 3t1a | 5MA | Gag-Pol polyprotein | 2.7.7.49 | 0.549 | |
| 3lal | KRV | Gag-Pol polyprotein | 2.7.7.49 | 0.537 | |
| 4h4m | 494 | Gag-Pol polyprotein | 2.7.7.49 | 0.534 | |
| 3dya | PZL | Gag-Pol polyprotein | 2.7.7.49 | 0.532 | |
| 4rw6 | 494 | Gag-Pol polyprotein | 2.7.7.49 | 0.529 | |
| 4mfb | 29T | Gag-Pol polyprotein | 2.7.7.49 | 0.528 | |
| 3dok | GWJ | Pol protein | / | 0.523 | |
| 4rw4 | 494 | Gag-Pol polyprotein | 2.7.7.49 | 0.523 | |
| 3lak | KR1 | Gag-Pol polyprotein | 2.7.7.49 | 0.515 | |
| 2won | ZZE | Gag-Pol polyprotein | 2.7.7.49 | 0.511 | |
| 3tam | M06 | Gag-Pol polyprotein | 2.7.7.49 | 0.509 | |
| 2ynh | EUR | Gag-Pol polyprotein | 2.7.7.49 | 0.500 | |
| 3t19 | 5MA | Gag-Pol polyprotein | 2.7.7.49 | 0.500 | |
| 2ynf | WHU | Gag-Pol polyprotein | 2.7.7.49 | 0.497 | |
| 3dlg | GWE | Gag-Pol polyprotein | 2.7.7.49 | 0.493 | |
| 1rt1 | MKC | Gag-Pol polyprotein | 2.7.7.49 | 0.491 | |
| 1c1b | GCA | Gag-Pol polyprotein | 2.7.7.49 | 0.488 | |
| 3dle | GFA | Gag-Pol polyprotein | 2.7.7.49 | 0.483 | |
| 3drr | R8E | Gag-Pol polyprotein | 2.7.7.49 | 0.478 | |
| 3qlh | T27 | Gag-Pol polyprotein | 2.7.7.49 | 0.477 | |
| 4lsl | 1YQ | Gag-Pol polyprotein | 2.7.7.49 | 0.475 | |
| 3irx | UDR | Gag-Pol polyprotein | 2.7.7.49 | 0.473 | |
| 3dmj | GWE | Pol protein | / | 0.465 |