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 |
|---|---|---|---|
| 9gss | GTX | Glutathione S-transferase P | 2.5.1.18 |
| PDB ID | HET | Uniprot Name | EC Number | Cavity Similarity |
Align |
|---|---|---|---|---|---|
| 9gss | GTX | Glutathione S-transferase P | 2.5.1.18 | 1.000 | |
| 13gs | SAS | Glutathione S-transferase P | 2.5.1.18 | 0.807 | |
| 17gs | GTX | Glutathione S-transferase P | 2.5.1.18 | 0.788 | |
| 2a2s | GSN | Glutathione S-transferase P | 2.5.1.18 | 0.709 | |
| 12gs | 0HH | Glutathione S-transferase P | 2.5.1.18 | 0.689 | |
| 3pgt | GBX | Glutathione S-transferase P | 2.5.1.18 | 0.639 | |
| 2glr | GTX | Glutathione S-transferase P 1 | 2.5.1.18 | 0.633 | |
| 3gus | N11 | Glutathione S-transferase P | 2.5.1.18 | 0.631 | |
| 2j9h | GTX | Glutathione S-transferase P | 2.5.1.18 | 0.630 | |
| 2oa7 | GTX | Glutathione S-transferase P 1 | 2.5.1.18 | 0.627 | |
| 1pgt | GTX | Glutathione S-transferase P | 2.5.1.18 | 0.626 | |
| 2oad | GTB | Glutathione S-transferase P 1 | 2.5.1.18 | 0.623 | |
| 1gti | GTB | Glutathione S-transferase P 1 | 2.5.1.18 | 0.621 | |
| 3ie3 | N11 | Glutathione S-transferase P | 2.5.1.18 | 0.610 | |
| 1aqx | GTD | Glutathione S-transferase P | 2.5.1.18 | 0.608 | |
| 3csj | CBL | Glutathione S-transferase P | 2.5.1.18 | 0.568 | |
| 2pgt | GPR | Glutathione S-transferase P | 2.5.1.18 | 0.566 | |
| 20gs | CBD | Glutathione S-transferase P | 2.5.1.18 | 0.562 | |
| 3o76 | GTB | Glutathione S-transferase P 1 | 2.5.1.18 | 0.548 | |
| 1gss | LEE | Glutathione S-transferase P | 2.5.1.18 | 0.528 | |
| 1aqv | 0HG | Glutathione S-transferase P | 2.5.1.18 | 0.520 | |
| 3n9j | EAA | Glutathione S-transferase P | 2.5.1.18 | 0.514 | |
| 3dgq | EAA | Glutathione S-transferase P | 2.5.1.18 | 0.511 | |
| 2oac | GTB | Glutathione S-transferase P 1 | 2.5.1.18 | 0.491 | |
| 2gst | GPS | Glutathione S-transferase Mu 1 | 2.5.1.18 | 0.466 | |
| 2vqb | NAP | Putative flavin-containing monooxygenase | / | 0.465 | |
| 1xdd | AAY | Integrin alpha-L | / | 0.464 | |
| 3dy8 | 5GP | High affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A | / | 0.464 | |
| 2yy2 | IBM | High affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A | / | 0.461 | |
| 4bfz | ZVZ | Pantothenate kinase | 2.7.1.33 | 0.461 | |
| 3br3 | ET | HTH-type transcriptional regulator QacR | / | 0.460 | |
| 3dyl | IBM | High affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A | / | 0.460 | |
| 1nup | NMN | Nicotinamide/nicotinic acid mononucleotide adenylyltransferase 3 | / | 0.459 | |
| 3e32 | ED2 | Protein farnesyltransferase subunit beta | 2.5.1.58 | 0.457 | |
| 3eu5 | GBO | Protein farnesyltransferase subunit beta | 2.5.1.58 | 0.457 | |
| 4e90 | 7RG | High affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A | / | 0.455 | |
| 3ai3 | NDP | NADPH-sorbose reductase | / | 0.454 | |
| 1n95 | FTH | Protein farnesyltransferase subunit beta | 2.5.1.58 | 0.452 | |
| 1n95 | HFP | Protein farnesyltransferase/geranylgeranyltransferase type-1 subunit alpha | / | 0.451 | |
| 1n95 | HFP | Protein farnesyltransferase subunit beta | 2.5.1.58 | 0.451 | |
| 1sa4 | JAN | Protein farnesyltransferase subunit beta | 2.5.1.58 | 0.451 | |
| 3gst | GPR | Glutathione S-transferase Mu 1 | 2.5.1.18 | 0.451 | |
| 1vi2 | NAD | Quinate/shikimate dehydrogenase | / | 0.450 | |
| 1tow | CRZ | Fatty acid-binding protein, adipocyte | / | 0.449 | |
| 3k3e | PDB | High affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A | / | 0.449 | |
| 4gtp | 7TP | Protein farnesyltransferase subunit beta | 2.5.1.58 | 0.449 | |
| 5c2t | FAD | Succinate dehydrogenase [ubiquinone] flavoprotein subunit, mitochondrial | / | 0.449 | |
| 3n19 | FNR | Xenobiotic reductase | / | 0.448 | |
| 1sa5 | BMV | Protein farnesyltransferase subunit beta | 2.5.1.58 | 0.446 | |
| 1ld8 | U49 | Protein farnesyltransferase subunit beta | 2.5.1.58 | 0.445 | |
| 2vd0 | D27 | Hematopoietic prostaglandin D synthase | / | 0.445 | |
| 2oc9 | IMH | Purine nucleoside phosphorylase | 2.4.2.1 | 0.444 | |
| 3dy8 | IBM | High affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A | / | 0.444 | |
| 3img | BZ2 | Pantothenate synthetase | 6.3.2.1 | 0.444 | |
| 4eag | ATP | 5'-AMP-activated protein kinase subunit gamma-1 | / | 0.444 | |
| 2bb3 | SAH | Cobalamin biosynthesis precorrin-6Y methylase (CbiE) | / | 0.443 | |
| 2qs3 | UBE | Glutamate receptor ionotropic, kainate 1 | / | 0.443 | |
| 1akb | PPD | Aspartate aminotransferase, mitochondrial | 2.6.1.1 | 0.442 | |
| 2x3j | ATP | AcsD | / | 0.442 | |
| 2ylr | NAP | Phenylacetone monooxygenase | 1.14.13.92 | 0.442 | |
| 1jcq | 739 | Protein farnesyltransferase subunit beta | 2.5.1.58 | 0.441 | |
| 1s7l | COA | Acetyl transferase | / | 0.440 | |
| 2a59 | LMZ | 6,7-dimethyl-8-ribityllumazine synthase | 2.5.1.78 | 0.440 | |
| 2fje | FAD | Adenylylsulfate reductase, subunit A (AprA) | / | 0.440 | |
| 3dyl | PCG | High affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A | / | 0.440 | |
| 3tqx | PLP | 2-amino-3-ketobutyrate coenzyme A ligase | / | 0.440 |