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 |
---|---|---|---|
1ya8 | MVB | Liver carboxylesterase 1 |
PDB ID | HET | Uniprot Name | EC Number | Binding Site Similarity |
Align |
---|---|---|---|---|---|
1ya8 | MVB | Liver carboxylesterase 1 | / | 1.000 | |
4m2b | UPG | UDP-glucose pyrophosphorylase | / | 0.479 | |
1dxy | NAD | D-2-hydroxyisocaproate dehydrogenase | 1.1.1 | 0.478 | |
1e8z | STU | Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform | 2.7.1.153 | 0.475 | |
2p9c | NAI | D-3-phosphoglycerate dehydrogenase | 1.1.1.95 | 0.471 | |
4gb9 | 0WR | Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform | 2.7.1.153 | 0.471 | |
4h6p | FMN | Chromate reductase | / | 0.471 | |
1sn5 | T3 | Transthyretin | / | 0.465 | |
3jqp | A2P | Ferredoxin--NADP reductase, apicoplast | / | 0.465 | |
1gjv | AGS | [3-methyl-2-oxobutanoate dehydrogenase [lipoamide]] kinase, mitochondrial | 2.7.11.4 | 0.463 | |
2chx | 090 | Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform | 2.7.1.153 | 0.462 | |
3t4e | NAD | Quinate/shikimate dehydrogenase | / | 0.462 | |
4egb | NAD | dTDP-glucose 4,6-dehydratase | / | 0.461 | |
1h50 | FMN | Pentaerythritol tetranitrate reductase | / | 0.459 | |
2izf | BTN | Streptavidin | / | 0.459 | |
3p84 | FMN | Pentaerythritol tetranitrate reductase | / | 0.459 | |
2bfo | NDP | Pteridine reductase 1 | 1.5.1.33 | 0.458 | |
4jx1 | CAH | Camphor 5-monooxygenase | 1.14.15.1 | 0.458 | |
1kru | IPT | Galactoside O-acetyltransferase | 2.3.1.18 | 0.455 | |
3p67 | FMN | Pentaerythritol tetranitrate reductase | / | 0.455 | |
4cqn | ILA | Leucine--tRNA ligase | / | 0.455 | |
4wh2 | ADP | N-acetylhexosamine 1-kinase | 2.7.1.162 | 0.455 | |
1knp | FAD | L-aspartate oxidase | 1.4.3.16 | 0.454 | |
2c94 | TSF | 6,7-dimethyl-8-ribityllumazine synthase | 2.5.1.78 | 0.454 | |
5fkl | TDC | Tetracycline repressor protein class D | / | 0.454 | |
1rvv | INI | 6,7-dimethyl-8-ribityllumazine synthase | 2.5.1.78 | 0.453 | |
3zu2 | NAI | Enoyl-[acyl-carrier-protein] reductase [NADH] | / | 0.453 | |
3a3y | OBN | Sodium/potassium-transporting ATPase subunit alpha | / | 0.452 | |
4jji | NAD | Alcohol dehydrogenase class-3 | / | 0.452 | |
2j5x | GSP | ADP-ribosylation factor 6 | / | 0.451 | |
2x7h | PFN | Prostaglandin reductase 3 | 1 | 0.451 | |
1dna | CB3 | Thymidylate synthase | / | 0.450 | |
1opb | RET | Retinol-binding protein 2 | / | 0.450 | |
2zsd | COA | Pantothenate kinase | 2.7.1.33 | 0.450 | |
4jyz | ATP | Glutamine--tRNA ligase | 6.1.1.18 | 0.450 | |
2owu | SAH | Diphthine synthase | / | 0.449 | |
3a1l | 2CC | Cytochrome P450 | / | 0.449 | |
3hmv | HBT | cAMP-specific 3',5'-cyclic phosphodiesterase 4B | 3.1.4.53 | 0.449 | |
3uko | NAD | Alcohol dehydrogenase class-3 | / | 0.449 | |
1pnq | NDP | NAD(P) transhydrogenase subunit beta | 1.6.1.2 | 0.447 | |
2o7o | DXT | Tetracycline repressor protein class D | / | 0.447 | |
2p2x | SAH | Diphthine synthase | / | 0.447 | |
2vbp | VB1 | Isopenicillin N synthase | 1.21.3.1 | 0.447 | |
3cd5 | 7HI | 3-hydroxy-3-methylglutaryl-coenzyme A reductase | 1.1.1.34 | 0.447 | |
3vmm | P0D | Alanine--anticapsin ligase | / | 0.447 | |
4euf | NAD | Trans-2-enoyl-CoA reductase [NADH] | / | 0.447 | |
1gzu | NMN | Nicotinamide/nicotinic acid mononucleotide adenylyltransferase 1 | 2.7.7.1 | 0.446 | |
2p9e | NAI | D-3-phosphoglycerate dehydrogenase | 1.1.1.95 | 0.446 | |
2vke | TAC | Tetracycline repressor protein class D | / | 0.446 | |
3ozd | 4CT | S-methyl-5'-thioadenosine phosphorylase | / | 0.446 | |
3eml | ZMA | Adenosine receptor A2a | / | 0.446 | |
1f8g | NAD | NAD(P) transhydrogenase subunit alpha part 1 | 1.6.1.2 | 0.445 | |
2gcg | NDP | Glyoxylate reductase/hydroxypyruvate reductase | 1.1.1.79 | 0.445 | |
3mel | TPP | Thiamin pyrophosphokinase family protein | / | 0.445 | |
4hf4 | 15H | cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A | 3.1.4.17 | 0.445 | |
5bt9 | NAP | 3-oxoacyl-(Acyl-carrier-protein) reductase | / | 0.445 | |
1jvs | NDP | 1-deoxy-D-xylulose 5-phosphate reductoisomerase | 1.1.1.267 | 0.444 | |
2dsh | SAH | Diphthine synthase | / | 0.444 | |
3bjc | WAN | cGMP-specific 3',5'-cyclic phosphodiesterase | / | 0.444 | |
3d7z | GK5 | Mitogen-activated protein kinase 14 | / | 0.444 | |
3m42 | HGF | MAP kinase-activated protein kinase 2 | 2.7.11.1 | 0.444 | |
4u0o | MTA | Lipoyl synthase 2 | / | 0.444 | |
2p9g | NAI | D-3-phosphoglycerate dehydrogenase | 1.1.1.95 | 0.443 | |
2pbw | DOQ | Glutamate receptor ionotropic, kainate 1 | / | 0.443 | |
2ydd | 2AM | 2',3'-cyclic-nucleotide 3'-phosphodiesterase | 3.1.4.37 | 0.443 | |
3af1 | GDP | Pantothenate kinase | 2.7.1.33 | 0.443 | |
5hes | 032 | Mitogen-activated protein kinase kinase kinase 20 | 2.7.11.25 | 0.443 | |
5hwq | CAA | Hydroxymethylglutaryl-CoA synthase | / | 0.443 | |
4xnw | 2ID | P2Y purinoceptor 1 | / | 0.443 | |
1adf | TAD | Alcohol dehydrogenase E chain | 1.1.1.1 | 0.442 | |
1jst | ATP | Cyclin-dependent kinase 2 | 2.7.11.22 | 0.442 | |
1obn | ASV | Isopenicillin N synthase | 1.21.3.1 | 0.442 | |
2ges | COK | Pantothenate kinase | 2.7.1.33 | 0.442 | |
2x7b | COA | N-alpha-acetyltransferase | 2.3.1 | 0.442 | |
2zsb | ADP | Pantothenate kinase | 2.7.1.33 | 0.442 | |
3fkt | SII | Beta-secretase 1 | 3.4.23.46 | 0.442 | |
3il1 | B5D | Glutamate receptor 2 | / | 0.442 | |
4ix5 | ANP | Uncharacterized protein | / | 0.442 | |
4ucu | 8HC | DNA ligase | / | 0.442 | |
5bsg | NAP | Pyrroline-5-carboxylate reductase | / | 0.442 | |
1h51 | FMN | Pentaerythritol tetranitrate reductase | / | 0.441 | |
1hzz | NAD | NAD(P) transhydrogenase subunit alpha part 1 | 1.6.1.2 | 0.441 | |
2xpw | OTC | Tetracycline repressor protein class D | / | 0.441 | |
3dhc | CYK | N-acyl homoserine lactonase AiiA | 3.1.1.81 | 0.441 | |
3f03 | FMN | Pentaerythritol tetranitrate reductase | / | 0.441 | |
3l7l | C2G | Teichoic acid poly(glycerol phosphate) polymerase | / | 0.441 | |
3rq8 | AP5 | ADP-dependent (S)-NAD(P)H-hydrate dehydratase | / | 0.441 | |
3vkj | FNR | Isopentenyl-diphosphate delta-isomerase | / | 0.441 | |
4ihl | 1F5 | 14-3-3 protein zeta/delta | / | 0.441 | |
4xoi | GTP | Transforming protein RhoA | / | 0.441 | |
1h63 | FMN | Pentaerythritol tetranitrate reductase | / | 0.440 | |
1mkd | ZAR | cAMP-specific 3',5'-cyclic phosphodiesterase 4D | 3.1.4.53 | 0.440 | |
1sq5 | ADP | Pantothenate kinase | 2.7.1.33 | 0.440 | |
1uyd | PU8 | Heat shock protein HSP 90-alpha | / | 0.440 | |
2qk8 | MTX | Dihydrofolate reductase | / | 0.440 | |
2rto | IMI | Streptavidin | / | 0.440 | |
2ydx | STL | Methionine adenosyltransferase 2 subunit beta | / | 0.440 | |
2yww | ATP | Aspartate carbamoyltransferase regulatory chain | / | 0.440 | |
2zre | AGS | Protein RecA | / | 0.440 | |
3p8j | FMN | Pentaerythritol tetranitrate reductase | / | 0.440 | |
4kf1 | HT5 | Aryldialkylphosphatase | 3.1.8.1 | 0.440 | |
4q71 | FAD | Bifunctional protein PutA | / | 0.440 | |
5ccy | TMP | Polymerase acidic protein | / | 0.440 |