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 |
---|---|---|---|
3lg5 | BTM | Epi-isozizaene synthase | 4.2.3.37 |
PDB ID | HET | Uniprot Name | EC Number | Cavity Similarity |
Align |
---|---|---|---|---|---|
3lg5 | BTM | Epi-isozizaene synthase | 4.2.3.37 | 1.000 | |
2rd2 | QSI | Glutamine--tRNA ligase | 6.1.1.18 | 0.479 | |
3zec | ANP | Adenosine monophosphate-protein transferase SoFic | 2.7.7.n1 | 0.476 | |
2rdn | 1PL | 1-deoxypentalenic acid 11-beta-hydroxylase | 1.14.11.35 | 0.472 | |
1w19 | T2P | 6,7-dimethyl-8-ribityllumazine synthase | 2.5.1.78 | 0.469 | |
1r58 | AO5 | Methionine aminopeptidase 2 | / | 0.468 | |
2e8u | IPE | Geranylgeranyl pyrophosphate synthase | / | 0.468 | |
1nqx | RLP | 6,7-dimethyl-8-ribityllumazine synthase | 2.5.1.78 | 0.465 | |
1euy | QSI | Glutamine--tRNA ligase | 6.1.1.18 | 0.464 | |
1yw7 | A41 | Methionine aminopeptidase 2 | / | 0.464 | |
3fr4 | F8A | Fatty acid-binding protein, adipocyte | / | 0.464 | |
4a7z | AY9 | Aldos-2-ulose dehydratase | / | 0.464 | |
1a26 | CNA | Poly [ADP-ribose] polymerase 1 | 2.4.2.30 | 0.462 | |
3pkd | Y10 | Methionine aminopeptidase 2 | / | 0.461 | |
1kyv | RBF | 6,7-dimethyl-8-ribityllumazine synthase | 2.5.1.78 | 0.458 | |
1yw9 | A84 | Methionine aminopeptidase 2 | / | 0.458 | |
1kyx | CRM | 6,7-dimethyl-8-ribityllumazine synthase | 2.5.1.78 | 0.454 | |
5kf2 | ACO | Predicted acetyltransferase | / | 0.454 | |
1dgf | NDP | Catalase | 1.11.1.6 | 0.453 | |
1y2b | DEE | cAMP-specific 3',5'-cyclic phosphodiesterase 4D | 3.1.4.53 | 0.453 | |
2qw8 | NAP | Eugenol synthase 1 | 1.1.1.318 | 0.453 | |
3ryk | TYD | dTDP-4-dehydrorhamnose 3,5-epimerase | / | 0.453 | |
5ebu | FMN | Lactate oxidase | / | 0.452 | |
1tou | B1V | Fatty acid-binding protein, adipocyte | / | 0.451 | |
2qt0 | NNR | Nicotinamide riboside kinase 1 | / | 0.450 | |
3c49 | KU8 | Poly [ADP-ribose] polymerase 3 | 2.4.2.30 | 0.450 | |
4j7h | TRH | PCZA361.3 | / | 0.450 | |
2geu | COK | Pantothenate kinase | 2.7.1.33 | 0.449 | |
2q94 | A04 | Methionine aminopeptidase | / | 0.449 | |
3jun | AJD | Phenazine biosynthesis protein A/B | / | 0.449 | |
1e6z | NGO | Chitinase | / | 0.448 | |
2idv | M7G | Eukaryotic translation initiation factor 4E-1 | / | 0.448 | |
4jxx | ATP | Glutamine--tRNA ligase | 6.1.1.18 | 0.448 | |
1gtr | ATP | Glutamine--tRNA ligase | 6.1.1.18 | 0.447 | |
1udt | VIA | cGMP-specific 3',5'-cyclic phosphodiesterase | / | 0.447 | |
2z4w | 749 | Geranylgeranyl pyrophosphate synthase | / | 0.447 | |
3elb | C5P | Ethanolamine-phosphate cytidylyltransferase | 2.7.7.14 | 0.447 | |
2ea4 | F79 | Methionine aminopeptidase 2 | / | 0.446 | |
4i10 | 1BS | Beta-secretase 1 | 3.4.23.46 | 0.446 | |
1vhn | FMN | tRNA-dihydrouridine synthase | / | 0.445 | |
2xb8 | XNW | 3-dehydroquinate dehydratase | 4.2.1.10 | 0.445 | |
5kf9 | ACO | Predicted acetyltransferase | / | 0.445 | |
1zis | INI | 6,7-dimethyl-8-ribityllumazine synthase | 2.5.1.78 | 0.444 | |
2q92 | B23 | Methionine aminopeptidase | / | 0.444 | |
4i6h | 1C8 | Serine/threonine-protein kinase PLK2 | 2.7.11.21 | 0.444 | |
1qru | ATP | Glutamine--tRNA ligase | 6.1.1.18 | 0.443 | |
1toj | HCI | Aspartate aminotransferase | 2.6.1.1 | 0.443 | |
2ouu | 35G | cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A | 3.1.4.17 | 0.443 | |
5liu | 388 | Aldo-keto reductase family 1 member B10 | 1.1.1 | 0.443 | |
1tow | CRZ | Fatty acid-binding protein, adipocyte | / | 0.442 | |
2d2g | DZZ | Phosphotriesterase | / | 0.442 | |
2gg0 | U11 | Methionine aminopeptidase | / | 0.442 | |
2q93 | B21 | Methionine aminopeptidase | / | 0.442 | |
2zs8 | ADP | Pantothenate kinase | 2.7.1.33 | 0.442 | |
4dya | 0MF | Nucleoprotein | / | 0.442 | |
5k8b | PDG | 8-amino-3,8-dideoxy-alpha-D-manno-octulosonate transaminase | / | 0.442 | |
1nqw | 5YL | 6,7-dimethyl-8-ribityllumazine synthase | 2.5.1.78 | 0.441 | |
3tqx | PLP | 2-amino-3-ketobutyrate coenzyme A ligase | / | 0.441 | |
4bfd | 8T3 | Beta-secretase 1 | 3.4.23.46 | 0.441 | |
4tnz | TTP | Deoxynucleoside triphosphate triphosphohydrolase SAMHD1 | 3.1.5 | 0.441 | |
5ero | 210 | Fusicoccadiene synthase | 2.5.1.29 | 0.441 | |
2c6c | 24I | Glutamate carboxypeptidase 2 | 3.4.17.21 | 0.440 | |
2z52 | H23 | Geranylgeranyl pyrophosphate synthase | / | 0.440 | |
3jsi | WTC | High affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A | / | 0.440 | |
5kf8 | ACO | Predicted acetyltransferase | / | 0.440 |