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 |
|---|---|---|---|
| 5kcp | NAJ | Alcohol dehydrogenase E chain | 1.1.1.1 |
| PDB ID | HET | Uniprot Name | EC Number | Cavity Similarity |
Align |
|---|---|---|---|---|---|
| 5kcp | NAJ | Alcohol dehydrogenase E chain | 1.1.1.1 | 1.000 | |
| 5kcp | PFB | Alcohol dehydrogenase E chain | 1.1.1.1 | 0.752 | |
| 5kj6 | NAJ | Alcohol dehydrogenase E chain | 1.1.1.1 | 0.711 | |
| 4xd2 | NAI | Alcohol dehydrogenase E chain | 1.1.1.1 | 0.669 | |
| 5kjc | NAJ | Alcohol dehydrogenase E chain | 1.1.1.1 | 0.668 | |
| 4dwv | NAJ | Alcohol dehydrogenase E chain | 1.1.1.1 | 0.653 | |
| 1het | NAD | Alcohol dehydrogenase E chain | 1.1.1.1 | 0.651 | |
| 5kje | NAJ | Alcohol dehydrogenase E chain | 1.1.1.1 | 0.650 | |
| 4nfh | NAJ | Alcohol dehydrogenase E chain | 1.1.1.1 | 0.642 | |
| 3oq6 | NAJ | Alcohol dehydrogenase E chain | 1.1.1.1 | 0.638 | |
| 5cdg | NAJ | Alcohol dehydrogenase E chain | 1.1.1.1 | 0.630 | |
| 4ng5 | NAJ | Alcohol dehydrogenase E chain | 1.1.1.1 | 0.627 | |
| 5kj1 | NAJ | Alcohol dehydrogenase E chain | 1.1.1.1 | 0.622 | |
| 5cdt | NAJ | Alcohol dehydrogenase E chain | 1.1.1.1 | 0.621 | |
| 1ht0 | NAD | Alcohol dehydrogenase 1C | 1.1.1.1 | 0.619 | |
| 1heu | NAD | Alcohol dehydrogenase E chain | 1.1.1.1 | 0.583 | |
| 1hf3 | NAD | Alcohol dehydrogenase E chain | 1.1.1.1 | 0.571 | |
| 5kje | PFB | Alcohol dehydrogenase E chain | 1.1.1.1 | 0.549 | |
| 5kj1 | PFB | Alcohol dehydrogenase E chain | 1.1.1.1 | 0.535 | |
| 5cds | PFB | Alcohol dehydrogenase E chain | 1.1.1.1 | 0.528 | |
| 1hld | NAD | Alcohol dehydrogenase E chain | 1.1.1.1 | 0.526 | |
| 5kjc | PFB | Alcohol dehydrogenase E chain | 1.1.1.1 | 0.525 | |
| 5cdg | PFB | Alcohol dehydrogenase E chain | 1.1.1.1 | 0.524 | |
| 6adh | NAD | Alcohol dehydrogenase E chain | 1.1.1.1 | 0.523 | |
| 1u3v | NAD | Alcohol dehydrogenase 1B | 1.1.1.1 | 0.518 | |
| 4nfh | PFB | Alcohol dehydrogenase E chain | 1.1.1.1 | 0.515 | |
| 5kj6 | PFB | Alcohol dehydrogenase E chain | 1.1.1.1 | 0.515 | |
| 5cdt | PFB | Alcohol dehydrogenase E chain | 1.1.1.1 | 0.514 | |
| 1agn | NAD | Alcohol dehydrogenase class 4 mu/sigma chain | 1.1.1.1 | 0.512 | |
| 4ng5 | PFB | Alcohol dehydrogenase E chain | 1.1.1.1 | 0.510 | |
| 4dxh | NAJ | Alcohol dehydrogenase E chain | 1.1.1.1 | 0.496 | |
| 3oq6 | PFB | Alcohol dehydrogenase E chain | 1.1.1.1 | 0.495 | |
| 4dwv | PFB | Alcohol dehydrogenase E chain | 1.1.1.1 | 0.492 | |
| 5kjf | NAJ | Alcohol dehydrogenase E chain | 1.1.1.1 | 0.484 | |
| 1hsz | NAD | Alcohol dehydrogenase 1B | 1.1.1.1 | 0.478 | |
| 4rqu | NAD | Alcohol dehydrogenase class-P | / | 0.465 | |
| 5kcz | NAJ | Alcohol dehydrogenase E chain | 1.1.1.1 | 0.457 | |
| 4nfs | NAJ | Alcohol dehydrogenase E chain | 1.1.1.1 | 0.454 | |
| 1e3e | NAI | Alcohol dehydrogenase 4 | 1.1.1.1 | 0.452 | |
| 1e3l | NAD | Alcohol dehydrogenase 4 | 1.1.1.1 | 0.452 | |
| 1adc | PAD | Alcohol dehydrogenase E chain | 1.1.1.1 | 0.443 | |
| 4dlb | NAD | S-(hydroxymethyl)glutathione dehydrogenase | / | 0.442 | |
| 3wle | NAD | (R)-specific carbonyl reductase | / | 0.440 | |
| 4c4o | NAD | SADH | / | 0.440 |