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 |
|---|---|---|---|
| 4yau | 2AM | NADPH--cytochrome P450 reductase |
| PDB ID | HET | Uniprot Name | EC Number | Cavity Similarity |
Align |
|---|---|---|---|---|---|
| 4yau | 2AM | NADPH--cytochrome P450 reductase | / | 1.000 | |
| 4yaw | 2AM | NADPH--cytochrome P450 reductase | / | 0.616 | |
| 4yal | 2AM | NADPH--cytochrome P450 reductase | / | 0.610 | |
| 4y7c | NAP | NADPH--cytochrome P450 reductase | / | 0.595 | |
| 4y9r | NAP | NADPH--cytochrome P450 reductase | / | 0.585 | |
| 1amo | NAP | NADPH--cytochrome P450 reductase | / | 0.584 | |
| 4y9u | NAP | NADPH--cytochrome P450 reductase | / | 0.558 | |
| 4yaf | 2AM | NADPH--cytochrome P450 reductase | / | 0.548 | |
| 3qft | NAP | NADPH--cytochrome P450 reductase | / | 0.531 | |
| 3qfr | NAP | NADPH--cytochrome P450 reductase | / | 0.530 | |
| 3qfs | NAP | NADPH--cytochrome P450 reductase | / | 0.526 | |
| 3qfc | NAP | NADPH--cytochrome P450 reductase | / | 0.516 | |
| 1ja1 | NAP | NADPH--cytochrome P450 reductase | / | 0.512 | |
| 3qe2 | NAP | NADPH--cytochrome P450 reductase | / | 0.512 | |
| 1f20 | NAP | Nitric oxide synthase, brain | 1.14.13.39 | 0.494 | |
| 3ojx | NAP | NADPH--cytochrome P450 reductase | / | 0.460 | |
| 2bpo | NAP | NADPH--cytochrome P450 reductase | / | 0.446 |