sc-PDB
An Annotated Database of Druggable Binding Sites from the Protein DataBank
An Annotated Database of Druggable Binding Sites from the Protein DataBank
Binding Sites 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
Binding Sites are considered as similar when the similarity value is greater than 0.44
| PDB ID | HET | Uniprot Name | EC Number |
|---|---|---|---|
| 2fvl | NAP | Aldo-keto reductase family 1 member C4 | 1.1.1.225 |
| PDB ID | HET | Uniprot Name | EC Number | Binding Site Similarity |
Align |
|---|---|---|---|---|---|
| 2fvl | NAP | Aldo-keto reductase family 1 member C4 | 1.1.1.225 | 1.000 | |
| 3uzw | NAP | 3-oxo-5-beta-steroid 4-dehydrogenase | / | 0.565 | |
| 1s1r | NAP | Aldo-keto reductase family 1 member C3 | / | 0.562 | |
| 4dz5 | NAP | Aldo-keto reductase family 1 member C3 | / | 0.553 | |
| 4jtq | NAP | Aldo-keto reductase family 1 member C2 | / | 0.545 | |
| 1q5m | NDP | Prostaglandin-E(2) 9-reductase | 1.1.1.189 | 0.536 | |
| 3buv | NAP | 3-oxo-5-beta-steroid 4-dehydrogenase | / | 0.532 | |
| 4xo7 | NAP | Aldo-keto reductase family 1 member C2 | / | 0.519 | |
| 2hej | NDP | Aldo-keto reductase family 1 member C21 | 1.1.1 | 0.517 | |
| 3h7r | NAP | Aldo-keto reductase family 4 member C8 | / | 0.507 | |
| 2p5n | NDP | Aldo-keto reductase family 1 member C21 | 1.1.1 | 0.503 | |
| 3caq | NDP | 3-oxo-5-beta-steroid 4-dehydrogenase | / | 0.500 | |
| 1s1p | NAP | Aldo-keto reductase family 1 member C3 | / | 0.498 | |
| 4l1x | NAP | Aldo-keto reductase family 1 member C2 | / | 0.497 | |
| 2hdj | NDP | Aldo-keto reductase family 1 member C2 | / | 0.496 | |
| 4jq3 | NAP | Aldo-keto reductase family 1 member C2 | / | 0.496 | |
| 3bv7 | NAP | 3-oxo-5-beta-steroid 4-dehydrogenase | / | 0.493 | |
| 3g1r | NAP | 3-oxo-5-beta-steroid 4-dehydrogenase | / | 0.486 | |
| 3dop | NAP | 3-oxo-5-beta-steroid 4-dehydrogenase | / | 0.480 | |
| 3wcz | NAP | Aldo-keto reductase AKR2E4 | / | 0.479 | |
| 3q67 | NAP | Aldose reductase | 1.1.1.21 | 0.454 | |
| 4ijr | NDP | D-arabinose dehydrogenase [NAD(P)+] heavy chain | 1.1.1.117 | 0.454 | |
| 3ln3 | NAD | Aldo-keto reductase family 1 member C13 | / | 0.452 | |
| 2j8t | NAP | Aldose reductase | 1.1.1.21 | 0.450 | |
| 1zgd | NAP | Chalcone reductase | / | 0.444 | |
| 2acs | NAP | Aldose reductase | 1.1.1.21 | 0.443 | |
| 1ah4 | NAP | Aldose reductase | 1.1.1.21 | 0.442 | |
| 1lwi | NAP | 3-alpha-hydroxysteroid dehydrogenase | 1.1.1.50 | 0.442 | |
| 3q65 | NAP | Aldose reductase | 1.1.1.21 | 0.442 |