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 |
|---|---|---|---|
| 3amt | ATP | tRNA(Ile2) 2-agmatinylcytidine synthetase TiaS | 6.3.4.22 |
| PDB ID | HET | Uniprot Name | EC Number | Binding Site Similarity |
Align |
|---|---|---|---|---|---|
| 3amt | ATP | tRNA(Ile2) 2-agmatinylcytidine synthetase TiaS | 6.3.4.22 | 1.000 | |
| 1xnj | ADP | Bifunctional 3'-phosphoadenosine 5'-phosphosulfate synthase 1 | 2.7.1.25 | 0.511 | |
| 4fj0 | NAP | 17beta-hydroxysteroid dehydrogenase | / | 0.493 | |
| 1nfr | NAD | 3-alpha-(or 20-beta)-hydroxysteroid dehydrogenase | 1.1.1.53 | 0.490 | |
| 2hrb | NAP | Carbonyl reductase [NADPH] 3 | 1.1.1.184 | 0.490 | |
| 1kt8 | ILP | Branched-chain-amino-acid aminotransferase, mitochondrial | 2.6.1.42 | 0.489 | |
| 3kdb | 006 | Gag-Pol polyprotein | 3.4.23.16 | 0.485 | |
| 1i6l | TYM | Tryptophan--tRNA ligase | 6.1.1.2 | 0.484 | |
| 2r8o | T5X | Transketolase 1 | / | 0.484 | |
| 1nff | NAD | 3-alpha-(or 20-beta)-hydroxysteroid dehydrogenase | 1.1.1.53 | 0.483 | |
| 4fj1 | NAP | 17beta-hydroxysteroid dehydrogenase | / | 0.482 | |
| 1g0n | NDP | Tetrahydroxynaphthalene reductase | 1.1.1.252 | 0.478 | |
| 1vl8 | NAP | Oxidoreductase, short chain dehydrogenase/reductase family | / | 0.478 | |
| 2tsr | UMP | Thymidylate synthase | 2.1.1.45 | 0.477 | |
| 4fj2 | NAP | 17beta-hydroxysteroid dehydrogenase | / | 0.475 | |
| 2f3r | G5P | Guanylate kinase | 2.7.4.8 | 0.474 | |
| 4nke | IPE | Farnesyl pyrophosphate synthase | 2.5.1.10 | 0.474 | |
| 3zgz | 84T | Leucine--tRNA ligase | / | 0.472 | |
| 1ozv | SAH | Ribulose-1,5 bisphosphate carboxylase/oxygenase large subunit N-methyltransferase, chloroplastic | 2.1.1.127 | 0.471 | |
| 1sny | NAP | LD36273p | / | 0.471 | |
| 3qwf | NAP | 17beta-hydroxysteroid dehydrogenase | / | 0.471 | |
| 1phk | ATP | Phosphorylase b kinase gamma catalytic chain, skeletal muscle/heart isoform | 2.7.11.19 | 0.470 | |
| 3fwr | ADP | Transcriptional repressor CcpN | / | 0.470 | |
| 4bri | UNP | Ectonucleoside triphosphate diphosphohydrolase I | / | 0.470 | |
| 2rc3 | NAD | CBS domain | / | 0.469 | |
| 4hwk | NAP | Sepiapterin reductase | 1.1.1.153 | 0.469 | |
| 4iqg | NAP | Short-chain dehydrogenase/reductase SDR | / | 0.469 | |
| 4j7u | NAP | Sepiapterin reductase | 1.1.1.153 | 0.469 | |
| 4ohx | ADP | Protein clpf-1 | / | 0.469 | |
| 5adh | APR | Alcohol dehydrogenase E chain | 1.1.1.1 | 0.469 | |
| 5idw | NAP | Short-chain dehydrogenase/reductase SDR | / | 0.469 | |
| 2b4q | NAP | Rhamnolipids biosynthesis 3-oxoacyl-[acyl-carrier-protein] reductase | 1.1.1.100 | 0.468 | |
| 3c50 | ADP | Rhodopsin kinase | / | 0.468 | |
| 2z6i | FMN | 2-nitropropane dioxygenase | / | 0.467 | |
| 1p9w | ANP | Type II secretion system protein E | / | 0.465 | |
| 2x3f | APC | Pantothenate synthetase | / | 0.465 | |
| 3opx | U5P | Suppressor of disruption of TFIIS | / | 0.465 | |
| 3sj7 | NDP | 3-oxoacyl-(Acyl-carrier-protein) reductase, putative | / | 0.465 | |
| 4yqf | GDP | Septin-9 | / | 0.465 | |
| 5jla | NAD | Putative short-chain dehydrogenase/reductase | / | 0.465 | |
| 2y42 | NAD | 3-isopropylmalate dehydrogenase | 1.1.1.85 | 0.464 | |
| 4is3 | NAD | 3alpha-hydroxy bile acid-CoA-ester 3-dehydrogenase 2 | 1.17.98.1 | 0.464 | |
| 4ttb | FMN | Iodotyrosine deiodinase 1 | / | 0.464 | |
| 4k39 | SAM | Anaerobic sulfatase-maturating enzyme | 1.8.98 | 0.463 | |
| 4ohw | ATP | Protein clpf-1 | / | 0.463 | |
| 1ipe | NDP | Tropinone reductase 2 | 1.1.1.236 | 0.462 | |
| 2geu | COK | Pantothenate kinase | 2.7.1.33 | 0.462 | |
| 3niz | ADP | Cdc2-like CDK2/CDC28 like protein kinase | / | 0.462 | |
| 4fl3 | ANP | Tyrosine-protein kinase SYK | 2.7.10.2 | 0.462 | |
| 4j7x | NAP | Sepiapterin reductase | 1.1.1.153 | 0.462 | |
| 5ahs | COA | Acyl-CoA dehydrogenase | / | 0.462 | |
| 5cwa | 0GA | Anthranilate synthase component 1 | 4.1.3.27 | 0.462 | |
| 5kjc | NAJ | Alcohol dehydrogenase E chain | 1.1.1.1 | 0.462 | |
| 1n2h | PAJ | Pantothenate synthetase | 6.3.2.1 | 0.461 | |
| 2gqt | FAD | UDP-N-acetylenolpyruvoylglucosamine reductase | / | 0.461 | |
| 2q1l | 882 | 3-hydroxy-3-methylglutaryl-coenzyme A reductase | 1.1.1.34 | 0.461 | |
| 3rv7 | RVB | Salicylate synthase | / | 0.461 | |
| 4e5o | UMP | Thymidylate synthase | 2.1.1.45 | 0.461 | |
| 5js6 | NAD | 17-beta-hydroxysteroid dehydrogenase 14 | 1.1.1 | 0.461 | |
| 5k5z | ANP | Uncharacterized protein | / | 0.461 | |
| 5kje | NAJ | Alcohol dehydrogenase E chain | 1.1.1.1 | 0.461 | |
| 1hk1 | T44 | Serum albumin | / | 0.460 | |
| 3kji | ADP | CO dehydrogenase/acetyl-CoA synthase complex, accessory protein CooC | / | 0.460 | |
| 2p2l | GDP | Ras-related C3 botulinum toxin substrate 1 | / | 0.459 | |
| 4j1t | NAD | NAD/NADP transhydrogenase alpha subunit 1 | / | 0.459 | |
| 1geu | FAD | Glutathione reductase | 1.8.1.7 | 0.458 | |
| 1k0j | FAD | p-hydroxybenzoate hydroxylase | / | 0.458 | |
| 3cgb | COA | Coenzyme A disulfide reductase | / | 0.458 | |
| 5by6 | UMP | Thymidylate synthase | / | 0.458 | |
| 4cpd | NAD | Alcohol dehydrogenase | / | 0.457 | |
| 1hv9 | UD1 | Bifunctional protein GlmU | / | 0.456 | |
| 2d1y | NAD | Oxidoreductase, short-chain dehydrogenase/reductase family | / | 0.456 | |
| 2djl | FMN | Dihydroorotate dehydrogenase (fumarate) | 1.3.98.1 | 0.456 | |
| 2nmv | ADP | UvrABC system protein B | / | 0.456 | |
| 3r7w | GNP | GTP-binding protein GTR2 | / | 0.456 | |
| 4z54 | GDP | Neuronal-specific septin-3 | / | 0.456 | |
| 3c3n | FMN | Dihydroorotate dehydrogenase (fumarate) | 1.3.98.1 | 0.455 | |
| 1dj3 | GDP | Adenylosuccinate synthetase, chloroplastic | / | 0.454 | |
| 2r8p | T6F | Transketolase 1 | / | 0.454 | |
| 2zsb | ADP | Pantothenate kinase | 2.7.1.33 | 0.454 | |
| 3bwj | ARX | cAMP-dependent protein kinase catalytic subunit alpha | 2.7.11.11 | 0.454 | |
| 3qv1 | NAD | Glyceraldehyde-3-phosphate dehydrogenase GAPA1, chloroplastic | 1.2.1.13 | 0.454 | |
| 3w2j | QRO | Dihydroorotate dehydrogenase (fumarate) | 1.3.98.1 | 0.454 | |
| 4oi2 | ADP | Protein clpf-1 | / | 0.454 | |
| 2a1h | GBN | Branched-chain-amino-acid aminotransferase, mitochondrial | 2.6.1.42 | 0.453 | |
| 2olr | ATP | Phosphoenolpyruvate carboxykinase (ATP) | / | 0.453 | |
| 2zz0 | FAD | Thioredoxin reductase 1, cytoplasmic | 1.8.1.9 | 0.453 | |
| 3e8n | VRA | Dual specificity mitogen-activated protein kinase kinase 1 | 2.7.12.2 | 0.453 | |
| 3lcj | COA | Phosphopantetheine adenylyltransferase | / | 0.453 | |
| 3nnu | EDB | Mitogen-activated protein kinase 14 | / | 0.453 | |
| 3ntd | COA | FAD-dependent pyridine nucleotide-disulphide oxidoreductase | / | 0.453 | |
| 3p19 | NDP | Putative blue fluorescent protein | / | 0.453 | |
| 3pb3 | SAH | 16S rRNA (adenine(1408)-N(1))-methyltransferase | 2.1.1.180 | 0.453 | |
| 4aw0 | ATP | 3-phosphoinositide-dependent protein kinase 1 | 2.7.11.1 | 0.453 | |
| 1b5e | DCM | Deoxycytidylate 5-hydroxymethyltransferase | 2.1.2.8 | 0.452 | |
| 1lde | NAD | Alcohol dehydrogenase E chain | 1.1.1.1 | 0.452 | |
| 1lol | XMP | Orotidine 5'-phosphate decarboxylase | 4.1.1.23 | 0.452 | |
| 2q46 | NAP | Uncharacterized protein At5g02240 | / | 0.452 | |
| 3g49 | NAP | Corticosteroid 11-beta-dehydrogenase isozyme 1 | 1.1.1.146 | 0.452 | |
| 4own | 5RG | Anthranilate phosphoribosyltransferase | / | 0.452 | |
| 1jvd | UD1 | UDP-N-acetylhexosamine pyrophosphorylase | 2.7.7.23 | 0.451 | |
| 1lrj | UD1 | UDP-glucose 4-epimerase | 5.1.3.2 | 0.451 | |
| 2eud | GCQ | Ribonucleoside-diphosphate reductase large chain 1 | 1.17.4.1 | 0.451 | |
| 3v0o | 4GW | Histo-blood group ABO system transferase | / | 0.451 | |
| 1i6k | TYM | Tryptophan--tRNA ligase | 6.1.1.2 | 0.450 | |
| 2dkn | NAI | 3-alpha-hydroxysteroid dehydrogenase | / | 0.450 | |
| 2h2j | SFG | Ribulose-1,5 bisphosphate carboxylase/oxygenase large subunit N-methyltransferase, chloroplastic | 2.1.1.127 | 0.450 | |
| 2ooy | ATP | 5'-AMP-activated protein kinase subunit gamma | / | 0.450 | |
| 2qln | F59 | Glycogen phosphorylase, muscle form | 2.4.1.1 | 0.450 | |
| 4cr8 | NAD | N-acylmannosamine 1-dehydrogenase | 1.1.1.233 | 0.450 | |
| 4r4u | COA | Acyl-CoA thioesterase II | / | 0.450 | |
| 4zoh | FAD | Putative oxidoreductase FAD-binding subunit | / | 0.450 | |
| 1xq6 | NAP | Uncharacterized protein At5g02240 | / | 0.449 | |
| 2hek | GDP | Uncharacterized protein | / | 0.449 | |
| 2vts | LZC | Cyclin-dependent kinase 2 | 2.7.11.22 | 0.449 | |
| 2z95 | NDP | GDP-mannose 4,6-dehydratase | / | 0.449 | |
| 3bu5 | ATP | Insulin receptor | 2.7.10.1 | 0.449 | |
| 3el4 | ROC | Gag-Pol polyprotein | 3.4.23.16 | 0.449 | |
| 3qiy | QI1 | Botulinum neurotoxin type A | 3.4.24.69 | 0.449 | |
| 4fv1 | EK4 | Mitogen-activated protein kinase 1 | 2.7.11.24 | 0.449 | |
| 4hmz | 18T | dTDP-4-dehydro-6-deoxyglucose 3-epimerase | 5.1.3.27 | 0.449 | |
| 4lrl | TTP | HD domain protein | / | 0.449 | |
| 4u0o | MTA | Lipoyl synthase 2 | / | 0.449 | |
| 5cdg | NAJ | Alcohol dehydrogenase E chain | 1.1.1.1 | 0.449 | |
| 1kp3 | ATP | Argininosuccinate synthase | 6.3.4.5 | 0.448 | |
| 2gjn | FMN | Nitronate monooxygenase | 1.13.12.16 | 0.448 | |
| 2wvj | TTP | Thymidine kinase, cytosolic | 2.7.1.21 | 0.448 | |
| 2zxg | S23 | Aminopeptidase N | 3.4.11.2 | 0.448 | |
| 3cow | 52H | Pantothenate synthetase | 6.3.2.1 | 0.448 | |
| 3dwj | H4B | Nitric oxide synthase, inducible | 1.14.13.39 | 0.448 | |
| 3tjz | GNP | ADP-ribosylation factor 1 | / | 0.448 | |
| 4gu9 | 4GU | Focal adhesion kinase 1 | 2.7.10.2 | 0.448 | |
| 1edo | NAP | 3-oxoacyl-[acyl-carrier-protein] reductase 1, chloroplastic | 1.1.1.100 | 0.447 | |
| 1rwb | NAD | Glucose 1-dehydrogenase | 1.1.1.47 | 0.447 | |
| 1yid | ATP | Tryptophan--tRNA ligase 2 | 6.1.1.2 | 0.447 | |
| 2ome | NAD | C-terminal-binding protein 2 | / | 0.447 | |
| 2py7 | ATP | Phosphoenolpyruvate carboxykinase (ATP) | / | 0.447 | |
| 2q64 | 1UN | Gag-Pol polyprotein | 3.4.23.16 | 0.447 | |
| 2vyx | FMN | Dodecin | / | 0.447 | |
| 3bgx | TMP | Thymidylate synthase | / | 0.447 | |
| 3otw | COA | Phosphopantetheine adenylyltransferase | / | 0.447 | |
| 3phj | DHK | Shikimate dehydrogenase (NADP(+)) | / | 0.447 | |
| 4ix5 | ANP | Uncharacterized protein | / | 0.447 | |
| 4yus | FMN | Family 3 adenylate cyclase | / | 0.447 | |
| 1pf9 | ADP | 60 kDa chaperonin | / | 0.446 | |
| 2bsl | FMN | Dihydroorotate dehydrogenase A (fumarate) | 1.3.98.1 | 0.446 | |
| 2bsm | BSM | Heat shock protein HSP 90-alpha | / | 0.446 | |
| 3iah | NAP | Putative oxoacyl-(Acyl carrier protein) reductase | / | 0.446 | |
| 3tsc | NAD | Uncharacterized protein | / | 0.446 | |
| 3ulk | NDP | Ketol-acid reductoisomerase (NADP(+)) | / | 0.446 | |
| 3wds | NAD | NADH-dependent quinuclidinone reductase | / | 0.446 | |
| 4dwv | NAJ | Alcohol dehydrogenase E chain | 1.1.1.1 | 0.446 | |
| 4onq | SFG | DNA methyltransferase | / | 0.446 | |
| 5eom | CTP | Putative nucleotidyltransferase MAB21L1 | / | 0.446 | |
| 5ig2 | NAD | Short-chain dehydrogenase/reductase SDR | / | 0.446 | |
| 1jki | NAI | Inositol-3-phosphate synthase | 5.5.1.4 | 0.445 | |
| 2qo9 | ANP | Ephrin type-A receptor 3 | 2.7.10.1 | 0.445 | |
| 4lcj | NAD | C-terminal-binding protein 2 | / | 0.445 | |
| 1a8g | 2Z4 | Gag-Pol polyprotein | 3.4.23.16 | 0.444 | |
| 1g7u | PEP | 2-dehydro-3-deoxyphosphooctonate aldolase | 2.5.1.55 | 0.444 | |
| 1ngi | ANP | Heat shock cognate 71 kDa protein | / | 0.444 | |
| 1noi | NTZ | Glycogen phosphorylase, muscle form | 2.4.1.1 | 0.444 | |
| 3af4 | GCP | Pantothenate kinase | 2.7.1.33 | 0.444 | |
| 3oz2 | FAD | Digeranylgeranylglycerophospholipid reductase | / | 0.444 | |
| 3phc | IM5 | Purine nucleoside phosphorylase | / | 0.444 | |
| 3r9i | ADP | Septum site-determining protein MinD | / | 0.444 | |
| 4b8w | NAP | GDP-L-fucose synthase | 1.1.1.271 | 0.444 | |
| 4bzq | ADP | Bifunctional enzyme CysN/CysC | 2.7.1.25 | 0.444 | |
| 4die | C5P | Cytidylate kinase | / | 0.444 | |
| 5cdt | NAJ | Alcohol dehydrogenase E chain | 1.1.1.1 | 0.444 | |
| 7upj | INU | Gag-Pol polyprotein | 3.4.23.16 | 0.444 | |
| 5dhh | DGW | Nociceptin receptor | / | 0.444 | |
| 1pxj | CK2 | Cyclin-dependent kinase 2 | 2.7.11.22 | 0.443 | |
| 1u3d | FAD | Cryptochrome-1 | / | 0.443 | |
| 2anb | 5GP | Guanylate kinase | 2.7.4.8 | 0.443 | |
| 2bkj | FMN | NADPH-flavin oxidoreductase | / | 0.443 | |
| 2xpu | TDC | Tetracycline repressor protein class D | / | 0.443 | |
| 3c4v | LIP | D-inositol 3-phosphate glycosyltransferase | 2.4.1.250 | 0.443 | |
| 3q8h | AO9 | 2-C-methyl-D-erythritol 2,4-cyclodiphosphate synthase | / | 0.443 | |
| 3uvr | 06F | Mitogen-activated protein kinase 14 | / | 0.443 | |
| 3w8r | ACP | Uridine kinase | / | 0.443 | |
| 4aqc | 88A | Tyrosine-protein kinase JAK2 | / | 0.443 | |
| 4c3r | ACP | Aurora kinase A | 2.7.11.1 | 0.443 | |
| 4dq1 | UMP | Thymidylate synthase | / | 0.443 | |
| 4eb4 | UMP | Thymidylate synthase | 2.1.1.45 | 0.443 | |
| 4r1f | ADP | DNA topoisomerase 2-alpha | 5.99.1.3 | 0.443 | |
| 5d3q | GDP | Dynamin-1 | 3.6.5.5 | 0.443 | |
| 5kcz | NAJ | Alcohol dehydrogenase E chain | 1.1.1.1 | 0.443 | |
| 1u3c | FAD | Cryptochrome-1 | / | 0.442 | |
| 1vzb | UMP | Thymidylate synthase | / | 0.442 | |
| 1w49 | APC | NTPase P4 | / | 0.442 | |
| 2phk | ATP | Phosphorylase b kinase gamma catalytic chain, skeletal muscle/heart isoform | 2.7.11.19 | 0.442 | |
| 2qrd | ADP | 5'-AMP-activated protein kinase subunit gamma | / | 0.442 | |
| 3ms4 | 21N | Glycogen phosphorylase, muscle form | 2.4.1.1 | 0.442 | |
| 3tr0 | 5GP | Guanylate kinase | / | 0.442 | |
| 3wb2 | YGP | Uncharacterized protein MJ0488 | / | 0.442 | |
| 4lez | 1SY | Cyclic GMP-AMP synthase | / | 0.442 | |
| 4qxr | 1YE | Stimulator of interferon genes protein | / | 0.442 | |
| 4tm0 | FAD | KtzI | / | 0.442 | |
| 1drt | PCV | Clavaminate synthase 1 | 1.14.11.21 | 0.441 | |
| 1heu | NAD | Alcohol dehydrogenase E chain | 1.1.1.1 | 0.441 | |
| 1u80 | C5P | Coenzyme A biosynthesis bifunctional protein CoaBC | 6.3.2.5 | 0.441 | |
| 2gr1 | FAD | Ferredoxin reductase | / | 0.441 | |
| 2nnq | T4B | Fatty acid-binding protein, adipocyte | / | 0.441 | |
| 2ohx | NAD | Alcohol dehydrogenase E chain | 1.1.1.1 | 0.441 | |
| 2qjo | NAD | Bifunctional NMN adenylyltransferase/Nudix hydrolase | 2.7.7.1 | 0.441 | |
| 3juo | AJD | Phenazine biosynthesis protein A/B | / | 0.441 | |
| 3m2r | COM | Methyl-coenzyme M reductase I subunit alpha | 2.8.4.1 | 0.441 | |
| 3m2r | COM | Methyl-coenzyme M reductase I subunit beta | 2.8.4.1 | 0.441 | |
| 3ogx | H1S | Peptidoglycan recognition protein 1 | / | 0.441 | |
| 3w0s | ANP | Hygromycin-B 4-O-kinase | 2.7.1.163 | 0.441 | |
| 4g1f | 0WG | Dipeptidyl peptidase 4 | / | 0.441 | |
| 4opl | FDA | Conserved Archaeal protein | / | 0.441 | |
| 1xr1 | ANP | Serine/threonine-protein kinase pim-1 | 2.7.11.1 | 0.440 | |
| 1z2n | ADP | Inositol-tetrakisphosphate 1-kinase | 2.7.1.134 | 0.440 | |
| 2ft9 | CHD | Fatty acid-binding protein 2, liver | / | 0.440 | |
| 2rio | ADP | Serine/threonine-protein kinase/endoribonuclease IRE1 | 2.7.11.1 | 0.440 | |
| 3cw9 | 01A | 4-chlorobenzoyl CoA ligase | / | 0.440 | |
| 3geg | NAD | Short-chain dehydrogenase/reductase SDR | / | 0.440 | |
| 3k5u | PFQ | Aurora kinase A | 2.7.11.1 | 0.440 | |
| 3oq6 | NAJ | Alcohol dehydrogenase E chain | 1.1.1.1 | 0.440 | |
| 3qtt | ANP | Pantothenate synthetase | / | 0.440 | |
| 3s55 | NAD | Putative short-chain dehydrogenase/reductase | / | 0.440 | |
| 3td7 | FAD | Probable FAD-linked sulfhydryl oxidase R596 | 1.8.3.2 | 0.440 | |
| 4bfs | ZVS | Pantothenate kinase | 2.7.1.33 | 0.440 | |
| 4dyn | 0MR | Nucleoprotein | / | 0.440 | |
| 4jxx | ATP | Glutamine--tRNA ligase | 6.1.1.18 | 0.440 | |
| 4qny | ANP | Mitogen activated protein kinase, putative | / | 0.440 | |
| 4r1l | ADP | Phenylacetate-coenzyme A ligase | / | 0.440 | |
| 4uoc | NCN | CinA-like protein | / | 0.440 |