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 |
|---|---|---|---|
| 2ble | 5GP | GMP reductase 1 |
| PDB ID | HET | Uniprot Name | EC Number | Cavity Similarity |
Align |
|---|---|---|---|---|---|
| 2ble | 5GP | GMP reductase 1 | / | 1.000 | |
| 2bwg | 5GP | GMP reductase 1 | / | 0.640 | |
| 4qq3 | XMP | Inosine-5'-monophosphate dehydrogenase | / | 0.504 | |
| 4dpw | AGS | Mevalonate diphosphate decarboxylase | / | 0.485 | |
| 1u4o | NDD | L-lactate dehydrogenase | 1.1.1.27 | 0.470 | |
| 2gs7 | ANP | Epidermal growth factor receptor | 2.7.10.1 | 0.464 | |
| 1me7 | RVP | Inosine-5'-monophosphate dehydrogenase | / | 0.463 | |
| 2xaa | NAD | Secondary alcohol dehydrogenase | / | 0.462 | |
| 1me7 | MOA | Inosine-5'-monophosphate dehydrogenase | / | 0.461 | |
| 2ooy | ATP | 5'-AMP-activated protein kinase subunit gamma | / | 0.461 | |
| 2zgz | GNP | Plasmid segregation protein ParM | / | 0.457 | |
| 1lbc | CYZ | Glutamate receptor 2 | / | 0.456 | |
| 2yyu | C5P | Orotidine 5'-phosphate decarboxylase | / | 0.456 | |
| 3ea4 | FAB | Acetolactate synthase, chloroplastic | 2.2.1.6 | 0.456 | |
| 4hbg | NDP | 3-oxoacyl-[acyl-carrier-protein] reductase | 1.1.1.100 | 0.456 | |
| 2zgy | GDP | Plasmid segregation protein ParM | / | 0.455 | |
| 1k6c | MK1 | Gag-Pol polyprotein | 3.4.23.16 | 0.454 | |
| 1u7t | NAD | 3-hydroxyacyl-CoA dehydrogenase type-2 | 1.1.1.35 | 0.453 | |
| 4fn4 | NAD | Short chain dehydrogenase | / | 0.452 | |
| 4yaf | 2AM | NADPH--cytochrome P450 reductase | / | 0.452 | |
| 1gco | NAD | Glucose 1-dehydrogenase | 1.1.1.47 | 0.451 | |
| 4gh5 | NAD | Short-chain dehydrogenase/reductase SDR | / | 0.451 | |
| 1g0n | NDP | Tetrahydroxynaphthalene reductase | 1.1.1.252 | 0.450 | |
| 1pdh | FAS | p-hydroxybenzoate hydroxylase | / | 0.450 | |
| 3q71 | AR6 | Poly [ADP-ribose] polymerase 14 | 2.4.2.30 | 0.449 | |
| 2hjr | APR | Malate dehydrogenase, adjacent gene encodes predicted lactate dehydrogenase | / | 0.448 | |
| 3p8z | 36A | Genome polyprotein | 2.1.1.56 | 0.448 | |
| 3uku | C69 | Actin-related protein 3 | / | 0.448 | |
| 2qo5 | CHD | Fatty acid-binding protein 10-A, liver basic | / | 0.447 | |
| 3uoz | FAD | 2-oxo-Delta(3)-4,5,5-trimethylcyclopentenylacetyl-CoA monooxygenase | 1.14.13.160 | 0.447 | |
| 2f4b | EHA | Peroxisome proliferator-activated receptor gamma | / | 0.446 | |
| 4die | C5P | Cytidylate kinase | / | 0.446 | |
| 1mwm | ADP | Plasmid segregation protein ParM | / | 0.445 | |
| 1z7y | AA5 | Cysteine synthase 1 | 2.5.1.47 | 0.445 | |
| 2cdu | FAD | NADH oxidase | / | 0.445 | |
| 2znq | 401 | Peroxisome proliferator-activated receptor delta | / | 0.445 | |
| 1gpd | NAD | Glyceraldehyde-3-phosphate dehydrogenase | 1.2.1.12 | 0.444 | |
| 1mg5 | NAI | Alcohol dehydrogenase | 1.1.1.1 | 0.444 | |
| 3nug | NAD | Pyridoxal 4-dehydrogenase | 1.1.1.107 | 0.444 | |
| 3nwx | KVS | Gag-Pol polyprotein | 3.4.23.16 | 0.444 | |
| 3s55 | NAD | Putative short-chain dehydrogenase/reductase | / | 0.444 | |
| 1j21 | ATP | Argininosuccinate synthase | / | 0.443 | |
| 1kf6 | FAD | Fumarate reductase flavoprotein subunit | 1.3.5.4 | 0.443 | |
| 1xq6 | NAP | Uncharacterized protein At5g02240 | / | 0.443 | |
| 2qnq | QN3 | Gag-Pol polyprotein | 3.4.23.16 | 0.443 | |
| 3anm | NDP | 1-deoxy-D-xylulose 5-phosphate reductoisomerase | 1.1.1.267 | 0.443 | |
| 3bgb | LJG | Gag-Pol polyprotein | 3.4.23.16 | 0.443 | |
| 4fj0 | NAP | 17beta-hydroxysteroid dehydrogenase | / | 0.443 | |
| 1yba | NAD | D-3-phosphoglycerate dehydrogenase | 1.1.1.95 | 0.442 | |
| 2om9 | AJA | Peroxisome proliferator-activated receptor gamma | / | 0.442 | |
| 2p5u | NAD | UDP-glucose 4-epimerase | / | 0.442 | |
| 3w0g | W07 | Vitamin D3 receptor | / | 0.442 | |
| 4ntd | FAD | Thioredoxin reductase | / | 0.442 | |
| 4ydu | ADP | tRNA N6-adenosine threonylcarbamoyltransferase | / | 0.442 | |
| 1civ | NAP | Malate dehydrogenase [NADP], chloroplastic | 1.1.1.82 | 0.441 | |
| 2ewm | NAD | (S)-1-Phenylethanol dehydrogenase | 1.1.1.311 | 0.441 | |
| 2gmh | FAD | Electron transfer flavoprotein-ubiquinone oxidoreductase, mitochondrial | 1.5.5.1 | 0.441 | |
| 2o23 | NAD | 3-hydroxyacyl-CoA dehydrogenase type-2 | 1.1.1.35 | 0.441 | |
| 4qec | NAP | ElxO | / | 0.441 | |
| 1bmd | NAD | Malate dehydrogenase | / | 0.440 | |
| 2fzn | FAD | Bifunctional protein PutA | 1.5.5.2 | 0.440 | |
| 3fsk | RO6 | Mitogen-activated protein kinase 14 | / | 0.440 |