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 |
|---|---|---|---|
| 3s79 | ASD | Aromatase | 1.14.14.14 |
| PDB ID | HET | Uniprot Name | EC Number | Cavity Similarity |
Align |
|---|---|---|---|---|---|
| 3s79 | ASD | Aromatase | 1.14.14.14 | 1.000 | |
| 4dvq | 1CA | Cytochrome P450 11B2, mitochondrial | 1.14.15.4 | 0.485 | |
| 4k9u | 5AW | Cytochrome P450 3A4 | / | 0.469 | |
| 3ibd | CPZ | Cytochrome P450 2B6 | 1.14.13 | 0.467 | |
| 4k9v | 6AW | Cytochrome P450 3A4 | / | 0.464 | |
| 4ejh | 0QA | Cytochrome P450 2A13 | 1.14.14.1 | 0.459 | |
| 3tk3 | CPZ | Cytochrome P450 2B4 | 1.14.14.1 | 0.453 | |
| 1suo | CPZ | Cytochrome P450 2B4 | 1.14.14.1 | 0.452 | |
| 3t3r | 9PL | Cytochrome P450 2A6 | 1.14.13 | 0.452 | |
| 3t3q | 9PL | Cytochrome P450 2A6 | 1.14.13 | 0.451 | |
| 3ruk | AER | Steroid 17-alpha-hydroxylase/17,20 lyase | / | 0.449 | |
| 4nkv | AER | Steroid 17-alpha-hydroxylase/17,20 lyase | / | 0.449 | |
| 4uym | VOR | 14-alpha sterol demethylase Cyp51B | / | 0.446 | |
| 2q9f | C3S | Cholesterol 24-hydroxylase | / | 0.444 | |
| 3ua1 | 08Y | Cytochrome P450 3A4 | / | 0.442 |