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 |
|---|---|---|---|
| 1bdb | NAD | Cis-2,3-dihydrobiphenyl-2,3-diol dehydrogenase |
| PDB ID | HET | Uniprot Name | EC Number | Cavity Similarity |
Align |
|---|---|---|---|---|---|
| 1bdb | NAD | Cis-2,3-dihydrobiphenyl-2,3-diol dehydrogenase | / | 1.000 | |
| 3r3s | NAD | Putative oxidoreductase | / | 0.499 | |
| 3iah | NAP | Putative oxoacyl-(Acyl carrier protein) reductase | / | 0.485 | |
| 3p19 | NDP | Putative blue fluorescent protein | / | 0.485 | |
| 2wsb | NAD | Galactitol dehydrogenase | / | 0.480 | |
| 4hwk | NAP | Sepiapterin reductase | 1.1.1.153 | 0.479 | |
| 2wdz | NAD | Galactitol dehydrogenase | / | 0.477 | |
| 4bmv | NAP | Short-chain dehydrogenase | / | 0.477 | |
| 5jyd | NAD | Short chain dehydrogenase | / | 0.476 | |
| 3d3w | NAP | L-xylulose reductase | 1.1.1.10 | 0.473 | |
| 1uay | ADN | Oxidoreductase | / | 0.471 | |
| 4c7k | NAP | Corticosteroid 11-beta-dehydrogenase isozyme 1 | 1.1.1.146 | 0.470 | |
| 1fdu | NAP | Estradiol 17-beta-dehydrogenase 1 | 1.1.1.62 | 0.465 | |
| 3bhi | NAP | Carbonyl reductase [NADPH] 1 | 1.1.1.184 | 0.465 | |
| 2ylr | NAP | Phenylacetone monooxygenase | 1.14.13.92 | 0.463 | |
| 3w8e | NAD | 3-hydroxybutyrate dehydrogenase | / | 0.463 | |
| 1xg5 | NAP | Dehydrogenase/reductase SDR family member 11 | / | 0.460 | |
| 3a28 | NAD | L-2,3-butanediol dehydrogenase | 1.1.1.76 | 0.460 | |
| 4fj0 | NAP | 17beta-hydroxysteroid dehydrogenase | / | 0.458 | |
| 4cql | NAD | Estradiol 17-beta-dehydrogenase 8 | 1.1.1.62 | 0.456 | |
| 2q2v | NAD | Beta-D-hydroxybutyrate dehydrogenase | / | 0.454 | |
| 1xkq | NDP | Uncharacterized protein | / | 0.452 | |
| 3geg | NAD | Short-chain dehydrogenase/reductase SDR | / | 0.452 | |
| 4q71 | FAD | Bifunctional protein PutA | / | 0.451 | |
| 2a92 | NAI | L-lactate dehydrogenase | / | 0.450 | |
| 4iqg | NAP | Short-chain dehydrogenase/reductase SDR | / | 0.449 | |
| 4j7x | NAP | Sepiapterin reductase | 1.1.1.153 | 0.449 | |
| 3up4 | FAD | 2-oxo-Delta(3)-4,5,5-trimethylcyclopentenylacetyl-CoA monooxygenase | 1.14.13.160 | 0.448 | |
| 1e3s | NAD | 3-hydroxyacyl-CoA dehydrogenase type-2 | 1.1.1.35 | 0.447 | |
| 1dxy | NAD | D-2-hydroxyisocaproate dehydrogenase | 1.1.1 | 0.446 | |
| 3l77 | NJP | Short-chain alcohol dehydrogenase | / | 0.446 | |
| 1ae1 | NAP | Tropinone reductase 1 | / | 0.445 | |
| 2z1m | NDP | GDP-mannose 4,6-dehydratase | / | 0.444 | |
| 1iy8 | NAD | Levodione reductase | / | 0.443 | |
| 1pr9 | NAP | L-xylulose reductase | 1.1.1.10 | 0.443 | |
| 1sny | NAP | LD36273p | / | 0.443 | |
| 3rk1 | ATP | N-type ATP pyrophosphatase superfamily | / | 0.443 | |
| 1xse | NDP | Corticosteroid 11-beta-dehydrogenase isozyme 1 | 1.1.1.146 | 0.442 | |
| 3opx | U5P | Suppressor of disruption of TFIIS | / | 0.442 | |
| 4oaq | NDP | R-specific carbonyl reductase | / | 0.442 | |
| 2ohx | NAD | Alcohol dehydrogenase E chain | 1.1.1.1 | 0.440 | |
| 4j7u | NAP | Sepiapterin reductase | 1.1.1.153 | 0.440 |