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 |
---|---|---|---|
1dp2 | LPB | Thiosulfate sulfurtransferase |
PDB ID | HET | Uniprot Name | EC Number | Binding Site Similarity |
Align |
---|---|---|---|---|---|
1dp2 | LPB | Thiosulfate sulfurtransferase | / | 1.000 | |
4uz6 | SCR | Palmitoleoyl-protein carboxylesterase NOTUM | / | 0.504 | |
1rvv | INI | 6,7-dimethyl-8-ribityllumazine synthase | 2.5.1.78 | 0.503 | |
2gev | COK | Pantothenate kinase | 2.7.1.33 | 0.502 | |
5agl | H4B | Nitric oxide synthase, brain | 1.14.13.39 | 0.500 | |
4fvz | H4B | Nitric oxide synthase, brain | 1.14.13.39 | 0.497 | |
1pt8 | ACO | Formyl-CoA:oxalate CoA-transferase | / | 0.496 | |
3af1 | GDP | Pantothenate kinase | 2.7.1.33 | 0.491 | |
3jta | H4B | Nitric oxide synthase, brain | 1.14.13.39 | 0.491 | |
2zs9 | ADP | Pantothenate kinase | 2.7.1.33 | 0.489 | |
2zsa | ADP | Pantothenate kinase | 2.7.1.33 | 0.488 | |
3inr | GDU | UDP-galactopyranose mutase | 5.4.99.9 | 0.486 | |
2mji | KTR | Fatty acid-binding protein, intestinal | / | 0.484 | |
3q9a | H4B | Nitric oxide synthase, brain | 1.14.13.39 | 0.483 | |
1fmj | RTL | Retinol dehydratase | / | 0.480 | |
3px3 | T3Q | dTDP-3-amino-3,6-dideoxy-alpha-D-glucopyranose N,N-dimethyltransferase | 2.1.1.235 | 0.479 | |
4kq1 | U5P | Glycogen [starch] synthase | / | 0.479 | |
3dr7 | GPD | GDP-perosamine synthase | / | 0.478 | |
3jt4 | H4B | Nitric oxide synthase, brain | 1.14.13.39 | 0.478 | |
1hb3 | SCV | Isopenicillin N synthase | 1.21.3.1 | 0.476 | |
2zs8 | ADP | Pantothenate kinase | 2.7.1.33 | 0.476 | |
3frk | TQP | QdtB | / | 0.476 | |
3zoi | M2W | Isopenicillin N synthase | 1.21.3.1 | 0.475 | |
5agk | H4B | Nitric oxide synthase, brain | 1.14.13.39 | 0.475 | |
2y60 | M8F | Isopenicillin N synthase | 1.21.3.1 | 0.474 | |
3jt6 | H4B | Nitric oxide synthase, brain | 1.14.13.39 | 0.474 | |
2geu | COK | Pantothenate kinase | 2.7.1.33 | 0.473 | |
3q7f | ED2 | Uncharacterized protein | / | 0.473 | |
4drj | RAP | Serine/threonine-protein kinase mTOR | 2.7.11.1 | 0.473 | |
4drj | RAP | Peptidyl-prolyl cis-trans isomerase FKBP4 | 5.2.1.8 | 0.473 | |
3hgo | FMN | 12-oxophytodienoate reductase 3 | 1.3.1.42 | 0.471 | |
4lez | 1SY | Cyclic GMP-AMP synthase | / | 0.471 | |
2ges | COK | Pantothenate kinase | 2.7.1.33 | 0.469 | |
4cjx | 9L9 | C-1-tetrahydrofolate synthase, cytoplasmic, putative | / | 0.469 | |
4k88 | HFG | Bifunctional glutamate/proline--tRNA ligase | 6.1.1.15 | 0.469 | |
1pt5 | ACO | Formyl-CoA:oxalate CoA-transferase | / | 0.468 | |
1qiq | ACC | Isopenicillin N synthase | 1.21.3.1 | 0.468 | |
4eso | NAP | Putative oxidoreductase | / | 0.468 | |
3c8a | ARG_ARG_GLY_LEU_NH2 | Botulinum neurotoxin type A | 3.4.24.69 | 0.467 | |
1qjf | ACS | Isopenicillin N synthase | 1.21.3.1 | 0.466 | |
3zky | WT4 | Isopenicillin N synthase | 1.21.3.1 | 0.466 | |
3af3 | GCP | Pantothenate kinase | 2.7.1.33 | 0.465 | |
3jt3 | H4B | Nitric oxide synthase, brain | 1.14.13.39 | 0.465 | |
1eyy | NAP | NADP-dependent fatty aldehyde dehydrogenase | 1.2.1.4 | 0.464 | |
4gtv | 7TR | Geranylgeranyl transferase type-2 subunit beta | 2.5.1.60 | 0.464 | |
2bu9 | HFV | Isopenicillin N synthase | 1.21.3.1 | 0.463 | |
2xei | ARK | Glutamate carboxypeptidase 2 | 3.4.17.21 | 0.463 | |
4dri | RAP | Serine/threonine-protein kinase mTOR | 2.7.11.1 | 0.463 | |
4dri | RAP | Peptidyl-prolyl cis-trans isomerase FKBP5 | 5.2.1.8 | 0.463 | |
1k9s | FM1 | Purine nucleoside phosphorylase DeoD-type | / | 0.462 | |
2vbd | V10 | Isopenicillin N synthase | 1.21.3.1 | 0.462 | |
2vcm | M11 | Isopenicillin N synthase | 1.21.3.1 | 0.462 | |
3mz9 | BHN | Nickel-binding periplasmic protein | / | 0.462 | |
4dya | 0MF | Nucleoprotein | / | 0.462 | |
4k5e | H4B | Nitric oxide synthase, brain | 1.14.13.39 | 0.462 | |
3h4v | NAP | Pteridine reductase 1 | 1.5.1.33 | 0.461 | |
3pfh | T3Q | dTDP-3-amino-3,6-dideoxy-alpha-D-glucopyranose N,N-dimethyltransferase | 2.1.1.235 | 0.461 | |
5brp | PNG | Glycoside Hydrolase Family 13 | / | 0.461 | |
2g6j | 7AP | Nitric oxide synthase, brain | 1.14.13.39 | 0.460 | |
2wgs | 1AZ | Glutamine synthetase | 6.3.1.2 | 0.460 | |
3sop | GDP | Neuronal-specific septin-3 | / | 0.460 | |
1blz | ACV | Isopenicillin N synthase | 1.21.3.1 | 0.459 | |
1sa5 | BMV | Protein farnesyltransferase subunit beta | 2.5.1.58 | 0.459 | |
1zis | INI | 6,7-dimethyl-8-ribityllumazine synthase | 2.5.1.78 | 0.459 | |
2po3 | T4K | 4-dehydrase | / | 0.459 | |
2uag | UMA | UDP-N-acetylmuramoylalanine--D-glutamate ligase | 6.3.2.9 | 0.459 | |
3fuf | BES | Leukotriene A-4 hydrolase | 3.3.2.6 | 0.459 | |
3ryk | TYD | dTDP-4-dehydrorhamnose 3,5-epimerase | / | 0.459 | |
4uth | FMN | Xenobiotic reductase | / | 0.458 | |
1evj | NAD | Glucose--fructose oxidoreductase | 1.1.99.28 | 0.457 | |
1mmv | H4B | Nitric oxide synthase, brain | 1.14.13.39 | 0.456 | |
1toj | HCI | Aspartate aminotransferase | 2.6.1.1 | 0.456 | |
2lbv | EB4 | Extracellular fatty acid-binding protein | / | 0.456 | |
3nub | UD0 | UDP-2-acetamido-2-deoxy-3-oxo-D-glucuronate aminotransferase | 2.6.1.98 | 0.456 | |
1e64 | FAD | Ferredoxin--NADP reductase | 1.18.1.2 | 0.455 | |
2bxo | OPB | Serum albumin | / | 0.455 | |
4j7g | TRH | PCZA361.3 | / | 0.455 | |
1hb1 | OCV | Isopenicillin N synthase | 1.21.3.1 | 0.454 | |
1yw8 | A75 | Methionine aminopeptidase 2 | / | 0.454 | |
3buz | TAD | Iota toxin component Ia | / | 0.454 | |
3nks | ACJ | Protoporphyrinogen oxidase | 1.3.3.4 | 0.454 | |
3pz4 | 3PZ | Protein farnesyltransferase subunit beta | 2.5.1.58 | 0.454 | |
4b13 | X25 | Glycylpeptide N-tetradecanoyltransferase | / | 0.454 | |
4m2b | UPG | UDP-glucose pyrophosphorylase | / | 0.454 | |
5cc9 | DDF | Dihydrofolate reductase | 1.5.1.3 | 0.454 | |
1u1g | BBB | Uridine phosphorylase | 2.4.2.3 | 0.453 | |
2apc | UDM | Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase | 2.4.1.101 | 0.453 | |
4fm8 | 0UQ | Beta-secretase 1 | 3.4.23.46 | 0.453 | |
5c3r | HMU | Thymine dioxygenase | / | 0.453 | |
1pnq | NDP | NAD(P) transhydrogenase subunit beta | 1.6.1.2 | 0.452 | |
2cje | DUN | DUTPase | / | 0.452 | |
2g0n | GDP | Ras-related C3 botulinum toxin substrate 3 | / | 0.452 | |
2ix5 | CAA | Acyl-coenzyme A oxidase 4, peroxisomal | 1.3.3.6 | 0.452 | |
2vbp | VB1 | Isopenicillin N synthase | 1.21.3.1 | 0.452 | |
2zsb | ADP | Pantothenate kinase | 2.7.1.33 | 0.452 | |
3dr4 | G4M | GDP-perosamine synthase | / | 0.452 | |
3v0o | 4GW | Histo-blood group ABO system transferase | / | 0.452 | |
3wth | IM4 | Acetylcholine-binding protein | / | 0.452 | |
1lrk | UD1 | UDP-glucose 4-epimerase | 5.1.3.2 | 0.451 | |
1zvl | H4B | Nitric oxide synthase, brain | 1.14.13.39 | 0.451 | |
1zzr | H4B | Nitric oxide synthase, brain | 1.14.13.39 | 0.451 | |
2h8x | FMN | XenA | / | 0.451 | |
2jb4 | A14 | Isopenicillin N synthase | 1.21.3.1 | 0.451 | |
4d6q | PD2 | Lysine-specific demethylase 4D | 1.14.11 | 0.451 | |
2ehu | NAD | 1-pyrroline-5-carboxylate dehydrogenase | / | 0.450 | |
2wwj | Y28 | Lysine-specific demethylase 4A | / | 0.450 | |
3jq3 | ADP | Lombricine kinase | / | 0.450 | |
4wx2 | F6F | Tryptophan synthase alpha chain | / | 0.450 | |
4wx2 | F6F | Tryptophan synthase beta chain | 4.2.1.20 | 0.450 | |
1nhk | CMP | Nucleoside diphosphate kinase | 2.7.4.6 | 0.449 | |
2get | COK | Pantothenate kinase | 2.7.1.33 | 0.449 | |
2uxo | TAC | HTH-type transcriptional regulator TtgR | / | 0.449 | |
3l5l | FMN | Xenobiotic reductase | / | 0.449 | |
3n19 | FNR | Xenobiotic reductase | / | 0.449 | |
3p8i | FMN | Pentaerythritol tetranitrate reductase | / | 0.449 | |
1tw2 | ERT | Carminomycin 4-O-methyltransferase DnrK | 2.1.1.292 | 0.448 | |
4a3u | FMN | NADH:flavin oxidoreductase/NADH oxidase | / | 0.448 | |
4h6p | FMN | Chromate reductase | / | 0.448 | |
4tyq | AP5 | Adenylate kinase | / | 0.448 | |
1om5 | H4B | Nitric oxide synthase, brain | 1.14.13.39 | 0.447 | |
1xr2 | C2F | 5-methyltetrahydropteroyltriglutamate--homocysteine methyltransferase | 2.1.1.14 | 0.447 | |
1yun | ATP | Probable nicotinate-nucleotide adenylyltransferase | 2.7.7.18 | 0.447 | |
2e99 | B08 | Ditrans,polycis-undecaprenyl-diphosphate synthase ((2E,6E)-farnesyl-diphosphate specific) | 2.5.1.31 | 0.447 | |
2rdn | 1PL | 1-deoxypentalenic acid 11-beta-hydroxylase | 1.14.11.35 | 0.447 | |
2zsd | COA | Pantothenate kinase | 2.7.1.33 | 0.447 | |
3l05 | SN0 | N-acetylornithine carbamoyltransferase | 2.1.3.9 | 0.447 | |
4bbh | YBN | Glycylpeptide N-tetradecanoyltransferase | / | 0.447 | |
4gi4 | 0EX | Queuine tRNA-ribosyltransferase | 2.4.2.29 | 0.447 | |
4h6k | FMN | NADPH dehydrogenase 1 | 1.6.99.1 | 0.447 | |
4kfq | KFQ | Glutamate receptor ionotropic, NMDA 1 | / | 0.447 | |
1obn | ASV | Isopenicillin N synthase | 1.21.3.1 | 0.446 | |
2jl1 | NAP | Triphenylmethane reductase | / | 0.446 | |
3af0 | GDP | Pantothenate kinase | 2.7.1.33 | 0.446 | |
3n14 | FMN | Xenobiotic reductase | / | 0.446 | |
3n5w | XFJ | Nitric oxide synthase, brain | 1.14.13.39 | 0.446 | |
3otw | COA | Phosphopantetheine adenylyltransferase | / | 0.446 | |
3tyc | XHP | Dihydropteroate synthase | / | 0.446 | |
4cx4 | H4B | Nitric oxide synthase, brain | 1.14.13.39 | 0.446 | |
4e2y | JHZ | Methyltransferase | / | 0.446 | |
4e2z | JHZ | Methyltransferase | / | 0.446 | |
4rlh | 0WE | Enoyl-[acyl-carrier-protein] reductase [NADH] | / | 0.446 | |
1e0j | ANP | DNA primase/helicase | 2.7.7 | 0.445 | |
1icp | FMN | 12-oxophytodienoate reductase 1 | 1.3.1.42 | 0.445 | |
1orr | CDP | CDP-paratose 2-epimerase | / | 0.445 | |
1q0r | AKT | Aclacinomycin methylesterase RdmC | 3.1.1.95 | 0.445 | |
1qom | H4B | Nitric oxide synthase, inducible | 1.14.13.39 | 0.445 | |
2c92 | TP6 | 6,7-dimethyl-8-ribityllumazine synthase | 2.5.1.78 | 0.445 | |
2i65 | NAD | ADP-ribosyl cyclase/cyclic ADP-ribose hydrolase 1 | 3.2.2.6 | 0.445 | |
3kro | IPE | Geranyl diphosphate synthase large subunit | / | 0.445 | |
4euf | NAD | Trans-2-enoyl-CoA reductase [NADH] | / | 0.445 | |
4lv5 | ADP | Rhoptry protein 5B | / | 0.445 | |
4rnv | FMN | NADPH dehydrogenase 1 | 1.6.99.1 | 0.445 | |
1el4 | CTZ | Obelin | / | 0.444 | |
1gti | GTB | Glutathione S-transferase P 1 | 2.5.1.18 | 0.444 | |
2eix | FAD | NADH-cytochrome b5 reductase | / | 0.444 | |
2imk | GTX | AGAP009194-PA | / | 0.444 | |
3g4k | ROL | cAMP-specific 3',5'-cyclic phosphodiesterase 4D | 3.1.4.53 | 0.444 | |
3qpg | 3QP | Aspartate aminotransferase | 2.6.1.1 | 0.444 | |
3rtn | RTN | Beta-secretase 1 | 3.4.23.46 | 0.444 | |
4hmz | 18T | dTDP-4-dehydro-6-deoxyglucose 3-epimerase | 5.1.3.27 | 0.444 | |
4qx5 | CMP | cGMP-dependent protein kinase 1 | 2.7.11.12 | 0.444 | |
5cho | FAD | Flavin reductase | / | 0.444 | |
1ahg | TYR_PLP | Aspartate aminotransferase | 2.6.1.1 | 0.443 | |
1esm | COA | Pantothenate kinase | 2.7.1.33 | 0.443 | |
1icq | FMN | 12-oxophytodienoate reductase 1 | 1.3.1.42 | 0.443 | |
2j3j | HC4 | NADPH-dependent oxidoreductase 2-alkenal reductase | 1.3.1.74 | 0.443 | |
2r59 | PH0 | Leukotriene A-4 hydrolase | 3.3.2.6 | 0.443 | |
3aez | GDP | Pantothenate kinase | 2.7.1.33 | 0.443 | |
3ftx | BES | Leukotriene A-4 hydrolase | 3.3.2.6 | 0.443 | |
3l67 | FMN | Xenobiotic reductase | / | 0.443 | |
3zrr | PXG | Serine-pyruvate aminotransferase (AgxT) | / | 0.443 | |
4d1o | H4B | Nitric oxide synthase, endothelial | 1.14.13.39 | 0.443 | |
4tnp | DCP | Deoxynucleoside triphosphate triphosphohydrolase SAMHD1 | 3.1.5 | 0.443 | |
4zm3 | PLP | Aminotransferase | / | 0.443 | |
1akc | PPE | Aspartate aminotransferase, mitochondrial | 2.6.1.1 | 0.442 | |
1h6a | NDP | Glucose--fructose oxidoreductase | 1.1.99.28 | 0.442 | |
1n0s | FLU | Bilin-binding protein | / | 0.442 | |
1x8l | OXR | Retinol dehydratase | / | 0.442 | |
2c9b | PUG | 6,7-dimethyl-8-ribityllumazine synthase | 2.5.1.78 | 0.442 | |
2ixk | TDO | dTDP-4-dehydrorhamnose 3,5-epimerase | 5.1.3.13 | 0.442 | |
2o6h | INI | 6,7-dimethyl-8-ribityllumazine synthase 1 | 2.5.1.78 | 0.442 | |
3fx6 | BPX | Carboxypeptidase A1 | 3.4.17.1 | 0.442 | |
3hgg | CHD | CmeR | / | 0.442 | |
3pz2 | 3PZ | Geranylgeranyl transferase type-2 subunit beta | 2.5.1.60 | 0.442 | |
4k97 | ATP | Cyclic GMP-AMP synthase | / | 0.442 | |
1amo | FMN | NADPH--cytochrome P450 reductase | / | 0.441 | |
1lb9 | DNQ | Glutamate receptor 2 | / | 0.441 | |
2c94 | TSF | 6,7-dimethyl-8-ribityllumazine synthase | 2.5.1.78 | 0.441 | |
2fm5 | M99 | cAMP-specific 3',5'-cyclic phosphodiesterase 4D | 3.1.4.53 | 0.441 | |
2poq | ISD | Trans-1,2-dihydrobenzene-1,2-diol dehydrogenase | 1.3.1.20 | 0.441 | |
2rqf | JH3 | Hemolymph juvenile hormone binding protein | / | 0.441 | |
3fr5 | I4A | Fatty acid-binding protein, adipocyte | / | 0.441 | |
3n66 | XFN | Nitric oxide synthase, brain | 1.14.13.39 | 0.441 | |
3to3 | ATP | Petrobactin biosynthesis protein AsbB | / | 0.441 | |
3zlm | ANP | Adenosine monophosphate-protein transferase NmFic | 2.7.7.n1 | 0.441 | |
4fgc | PQ0 | NADPH-dependent 7-cyano-7-deazaguanine reductase | 1.7.1.13 | 0.441 | |
1nup | NMN | Nicotinamide/nicotinic acid mononucleotide adenylyltransferase 3 | / | 0.440 | |
1y56 | FMN | Uncharacterized protein | / | 0.440 | |
1y56 | FMN | 382aa long hypothetical sarcosine oxidase | / | 0.440 | |
2ivi | ACW | Isopenicillin N synthase | 1.21.3.1 | 0.440 | |
2lfo | GCH | Fatty acid-binding protein, liver | / | 0.440 | |
2y05 | RAL | Prostaglandin reductase 1 | / | 0.440 | |
3af4 | GCP | Pantothenate kinase | 2.7.1.33 | 0.440 | |
3e30 | ED4 | Protein farnesyltransferase subunit beta | 2.5.1.58 | 0.440 | |
4b12 | C23 | Glycylpeptide N-tetradecanoyltransferase | / | 0.440 | |
4d2c | ALA_PHE | Di-or tripeptide:H+ symporter | / | 0.440 | |
4hn1 | TYD | dTDP-4-dehydro-6-deoxyglucose 3-epimerase | 5.1.3.27 | 0.440 | |
4jyz | ATP | Glutamine--tRNA ligase | 6.1.1.18 | 0.440 | |
4xou | ACP | Sarcoplasmic/endoplasmic reticulum calcium ATPase 1 | 3.6.3.8 | 0.440 |