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 |
|---|---|---|---|
| 4lsl | 1YQ | Gag-Pol polyprotein | 2.7.7.49 |
| PDB ID | HET | Uniprot Name | EC Number | Cavity Similarity |
Align |
|---|---|---|---|---|---|
| 4lsl | 1YQ | Gag-Pol polyprotein | 2.7.7.49 | 1.000 | |
| 4h4m | 494 | Gag-Pol polyprotein | 2.7.7.49 | 0.589 | |
| 3dok | GWJ | Pol protein | / | 0.552 | |
| 4h4o | 506 | Gag-Pol polyprotein | 2.7.7.49 | 0.548 | |
| 4mfb | 29T | Gag-Pol polyprotein | 2.7.7.49 | 0.526 | |
| 4rw6 | 494 | Gag-Pol polyprotein | 2.7.7.49 | 0.520 | |
| 2won | ZZE | Gag-Pol polyprotein | 2.7.7.49 | 0.519 | |
| 3t1a | 5MA | Gag-Pol polyprotein | 2.7.7.49 | 0.517 | |
| 3lal | KRV | Gag-Pol polyprotein | 2.7.7.49 | 0.516 | |
| 3c6t | M14 | Gag-Pol polyprotein | 2.7.7.49 | 0.514 | |
| 3c6u | M22 | Gag-Pol polyprotein | 2.7.7.49 | 0.513 | |
| 2b5j | 3AC | Gag-Pol polyprotein | 2.7.7.49 | 0.505 | |
| 3ffi | 3OB | Gag-Pol polyprotein | 2.7.7.49 | 0.503 | |
| 2ynh | EUR | Gag-Pol polyprotein | 2.7.7.49 | 0.497 | |
| 2be2 | R22 | Gag-Pol polyprotein | 2.7.7.49 | 0.492 | |
| 3drp | R8E | Gag-Pol polyprotein | 2.7.7.49 | 0.481 | |
| 3lam | KRP | Gag-Pol polyprotein | 2.7.7.49 | 0.480 | |
| 4rw4 | 494 | Gag-Pol polyprotein | 2.7.7.49 | 0.480 | |
| 3is9 | AC7 | Gag-Pol polyprotein | 2.7.7.49 | 0.468 | |
| 3dle | GFA | Gag-Pol polyprotein | 2.7.7.49 | 0.465 | |
| 2jle | I15 | Reverse transcriptase/RNaseH | / | 0.464 | |
| 3dmj | GWE | Pol protein | / | 0.458 | |
| 1c1b | GCA | Gag-Pol polyprotein | 2.7.7.49 | 0.457 | |
| 1c1c | 612 | Gag-Pol polyprotein | 2.7.7.49 | 0.451 | |
| 1rt1 | MKC | Gag-Pol polyprotein | 2.7.7.49 | 0.445 | |
| 2wuf | KEM | 4,5:9,10-diseco-3-hydroxy-5,9,17-trioxoandrosta-1(10),2-diene-4-oate hydrolase | 3.7.1.17 | 0.442 | |
| 3lan | KBT | Gag-Pol polyprotein | 2.7.7.49 | 0.441 |