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 |
---|---|---|---|
1az1 | ALR | Aldose reductase | 1.1.1.21 |
PDB ID | HET | Uniprot Name | EC Number | Cavity Similarity |
Align |
---|---|---|---|---|---|
1az1 | ALR | Aldose reductase | 1.1.1.21 | 1.000 | |
2nvd | ITB | Aldose reductase | 1.1.1.21 | 0.519 | |
1pwm | FID | Aldose reductase | 1.1.1.21 | 0.472 | |
3s3v | TOP | Dihydrofolate reductase | 1.5.1.3 | 0.460 | |
3n0h | TOP | Dihydrofolate reductase | 1.5.1.3 | 0.459 | |
1s3u | TQD | Dihydrofolate reductase | 1.5.1.3 | 0.457 | |
2acl | L05 | Oxysterols receptor LXR-alpha | / | 0.442 |