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sc-PDB

An Annotated Database of Druggable Binding Sites from the Protein DataBank

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Distribution of Cavity similarities measured by Shaper
You can zoom onto the graph by using the mouse to make a selection

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

Reference Protein Data Bank Entry :
PDB ID HET Uniprot Name EC Number
3wv8ATPHmd co-occurring protein HcgE

Complex with similar cavities

PDB ID HET Uniprot Name EC Number Cavity
Similarity
Align
3wv8ATPHmd co-occurring protein HcgE/1.000
2pbwDOQGlutamate receptor ionotropic, kainate 1/0.514
1trkTPPTransketolase 12.2.1.10.495
1b2lNDCAlcohol dehydrogenase1.1.1.10.490
4imfSI3N-acetylneuraminate lyase/0.490
3c36KAIGlutamate receptor ionotropic, kainate 1/0.489
2g8yNADHydroxycarboxylate dehydrogenase B/0.488
3dy85GPHigh affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A/0.485
3wqmB29Diterpene synthase3.1.7.80.484
1c3x8IGPurine nucleoside phosphorylase2.4.2.10.480
3uaxNOSPurine nucleoside phosphorylase DeoD-type/0.479
4e907RGHigh affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A/0.479
1lkeDOGBilin-binding protein/0.478
3dyqPCGHigh affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A/0.478
1gky5GPGuanylate kinase2.7.4.80.477
3c34KAIGlutamate receptor ionotropic, kainate 1/0.475
3c35KAIGlutamate receptor ionotropic, kainate 1/0.475
3i5xANPATP-dependent RNA helicase MSS116, mitochondrial3.6.4.130.475
3i8p8403-oxoacyl-[acyl-carrier-protein] synthase 22.3.1.1790.475
4da0GNGPurine nucleoside phosphorylase DeoD-type2.4.2.10.475
1q0rAKTAclacinomycin methylesterase RdmC3.1.1.950.474
2zevB71Geranylgeranyl pyrophosphate synthase/0.474
3bi6396Wee1-like protein kinase2.7.10.20.474
3h4vNAPPteridine reductase 11.5.1.330.474
2yac937Serine/threonine-protein kinase PLK12.7.11.210.472
2v7qATPATP synthase subunit alpha, mitochondrial/0.471
2v7qATPATP synthase subunit beta, mitochondrial3.6.3.140.471
4b1e6T6Beta-secretase 13.4.23.460.471
4twnB96Ephrin type-A receptor 32.7.10.10.471
1uaeUD1UDP-N-acetylglucosamine 1-carboxyvinyltransferase/0.470
2gevCOKPantothenate kinase2.7.1.330.470
2zevIPEGeranylgeranyl pyrophosphate synthase/0.470
1fduNAPEstradiol 17-beta-dehydrogenase 11.1.1.620.469
3dxmN24Actin-related protein 3/0.469
3k3hBYEHigh affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A/0.469
3uazNOSPurine nucleoside phosphorylase DeoD-type/0.468
1zdfUPGGlycogenin-12.4.1.1860.467
3jswJARHigh affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A/0.467
2jb2FADL-amino acid oxidase/0.466
3dysIBMHigh affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A/0.466
3h1vTK1Glucokinase2.7.1.20.466
3qgf46FGenome polyprotein2.7.7.480.466
1k4hAPQQueuine tRNA-ribosyltransferase2.4.2.290.464
2pnjCHDFerrochelatase, mitochondrial4.99.1.10.464
3af1GDPPantothenate kinase2.7.1.330.464
4gh6LUOHigh affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A/0.464
5c6cCMPcGMP-dependent protein kinase 22.7.11.120.464
2anb5GPGuanylate kinase2.7.4.80.463
3n87N873-dehydroquinate dehydratase4.2.1.100.463
3qakUKAAdenosine receptor A2a/0.463
2vigFADShort-chain specific acyl-CoA dehydrogenase, mitochondrial1.3.8.10.462
3a8wATPProtein kinase C iota type2.7.11.130.462
4l7g1W0Beta-secretase 13.4.23.460.462
5e5h0T1Succinyl-CoA:acetate CoA-transferase/0.462
4j36FADKynurenine 3-monooxygenase/0.461
4l7h1W1Beta-secretase 13.4.23.460.461
2az3CDPNucleoside diphosphate kinase/0.460
3b7dCNIGlutamate receptor 2/0.460
1aiqCB3Thymidylate synthase/0.459
1getFADGlutathione reductase1.8.1.70.459
2po7CHDFerrochelatase, mitochondrial4.99.1.10.459
4oztP1AEcdysone receptor, putative/0.459
2bxtC2DProthrombin3.4.21.50.458
3zkyWT4Isopenicillin N synthase1.21.3.10.458
4b0532DBeta-secretase 13.4.23.460.458
4bcaFADAlkyldihydroxyacetonephosphate synthase, peroxisomal2.5.1.260.458
4dldTZGGlutamate receptor ionotropic, kainate 1/0.458
1j1zATPArgininosuccinate synthase/0.457
4s1hADPPyridoxal kinase, putative/0.457
4zwpM44Xaa-Pro dipeptidase3.4.13.90.457
1nbuPH2Dihydroneopterin aldolase/0.456
2flhZEACytokinin-specific binding protein/0.456
2okcSAMProbable type I restriction enzyme BthVORF4518P M protein2.1.1.720.456
2pk3A2RGDP-6-deoxy-D-mannose reductase/0.456
2y99NADCis-2,3-dihydrobiphenyl-2,3-diol dehydrogenase1.3.1.560.456
2zatNAPDehydrogenase/reductase SDR family member 41.1.1.1840.456
3up0D7SaceDAF-12/0.456
4fr10V2Queuine tRNA-ribosyltransferase2.4.2.290.456
1aj22PHDihydropteroate synthase/0.455
3ivcFG4Pantothenate synthetase6.3.2.10.455
4o4eATPKinase/0.455
2p8uCOAHydroxymethylglutaryl-CoA synthase, cytoplasmic2.3.3.100.454
3up3XCAaceDAF-12/0.454
4bfsZVSPantothenate kinase2.7.1.330.454
5c8d5ADProbable transcriptional regulator/0.454
1e79ATPATP synthase subunit alpha, mitochondrial/0.453
1e79ATPATP synthase subunit beta, mitochondrial3.6.3.140.453
1nquRDL6,7-dimethyl-8-ribityllumazine synthase2.5.1.780.453
1t57FMNConserved protein/0.453
2wjoQUDBeta-secretase 13.4.23.460.453
3dy8IBMHigh affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A/0.453
1g63FMNEpidermin decarboxylase4.1.10.452
1pd9CO4Dihydrofolate reductase1.5.1.30.452
1q0zAKAAclacinomycin methylesterase RdmC3.1.1.950.452
1w29TS06,7-dimethyl-8-ribityllumazine synthase2.5.1.780.452
2dshSAHDiphthine synthase/0.452
2ejzSAHDiphthine synthase/0.452
2r5nTPPTransketolase 1/0.452
2xkeWI2Serine/threonine-protein kinase Nek22.7.11.10.452
3ufl508Beta-secretase 13.4.23.460.452
3vkjFNRIsopentenyl-diphosphate delta-isomerase/0.452
4da7AC2Purine nucleoside phosphorylase DeoD-type2.4.2.10.452
4h3g10QBeta-secretase 13.4.23.460.452
4s1iPLPPyridoxal kinase, putative/0.452
1e1qANPATP synthase subunit alpha, mitochondrial/0.451
1e1qANPATP synthase subunit beta, mitochondrial3.6.3.140.451
1kceCB3Thymidylate synthase/0.451
2wkyIBCGlutamate receptor ionotropic, kainate 1/0.451
2y882ERPhosphoribosyl isomerase A5.3.1.160.451
3v0m5GWHisto-blood group ABO system transferase/0.451
4fm80UQBeta-secretase 13.4.23.460.451
4o4fATPKinase/0.451
1j9zFADNADPH--cytochrome P450 reductase/0.450
1mokFAD2-oxopropyl-CoM reductase, carboxylating1.8.1.50.450
1mvtDTMDihydrofolate reductase1.5.1.30.450
1udtVIAcGMP-specific 3',5'-cyclic phosphodiesterase/0.450
2xtkAZMClass III chitinase ChiA1/0.450
3ribSAHN-lysine methyltransferase SMYD2/0.450
4bftZVTPantothenate kinase2.7.1.330.450
4m0cFMNFMN-dependent NADH-azoreductase 1/0.450
4n3l2FNProthrombin3.4.21.50.450
5k7uSAMN6-adenosine-methyltransferase 70 kDa subunit/0.450
1ex75GPGuanylate kinase2.7.4.80.449
1jnzFADAdenylylsulfate reductase, subunit A (AprA)/0.449
1n08ADPRiboflavin kinase2.7.1.260.449
3sqzCOAPutative hydroxymethylglutaryl-CoA synthase/0.449
3v0p4GWHisto-blood group ABO system transferase/0.449
3zxzKRWHepatocyte growth factor receptor2.7.10.10.449
4eplJAIJasmonic acid-amido synthetase JAR16.3.20.449
4h1e10JBeta-secretase 13.4.23.460.449
4l4xNDPAmphI/0.449
2ed3SAHDiphthine synthase/0.448
2fjaFADAdenylylsulfate reductase, subunit A (AprA)/0.448
2iejS48Protein farnesyltransferase subunit beta2.5.1.580.448
2jb1FADL-amino acid oxidase/0.448
2p2xSAHDiphthine synthase/0.448
2wo7ASVIsopenicillin N synthase1.21.3.10.448
2z4sADPChromosomal replication initiator protein DnaA/0.448
2zrxFMNIsopentenyl-diphosphate delta-isomerase/0.448
3upr1KXHLA class I histocompatibility antigen, B-57 alpha chain/0.448
4u0oMTALipoyl synthase 2/0.448
5hwoHMGHydroxymethylglutaryl-CoA synthase/0.448
1dfoPLGSerine hydroxymethyltransferase2.1.2.10.447
1pfyMSPMethionine--tRNA ligase6.1.1.100.447
1w6rGNTAcetylcholinesterase3.1.1.70.447
3k3ePDBHigh affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A/0.447
3sqwANPATP-dependent RNA helicase MSS116, mitochondrial3.6.4.130.447
3zv7NHGAcetylcholinesterase3.1.1.70.447
4fmqANPMitogen-activated protein kinase 12.7.11.240.447
5hq8SAHHistone-lysine N-methyltransferase SMYD32.1.1.430.447
1rfuADPPyridoxal kinase2.7.1.350.446
1trgCB3Thymidylate synthase/0.446
2dzbHH2Dihydropteroate synthase/0.446
2fjbSFDAdenylylsulfate reductase, subunit A (AprA)/0.446
2rl1UD1UDP-N-acetylglucosamine 1-carboxyvinyltransferase/0.446
2wqoVGKSerine/threonine-protein kinase Nek22.7.11.10.446
3e34ED1Protein farnesyltransferase/geranylgeranyltransferase type-1 subunit alpha/0.446
3e34ED1Protein farnesyltransferase subunit beta2.5.1.580.446
3fktSIIBeta-secretase 13.4.23.460.446
3x2fNAIAdenosylhomocysteinase/0.446
4bdoKAIGlutamate receptor ionotropic, kainate 2/0.446
4f3gKAIGlutamate receptor 3/0.446
4gki0JNAminoglycoside 3'-phosphotransferase AphA1-IAB/0.446
1pk92FAPurine nucleoside phosphorylase DeoD-type/0.445
2a57CRM6,7-dimethyl-8-ribityllumazine synthase2.5.1.780.445
2bjuIH4Plasmepsin-23.4.23.390.445
2nnlNAPDihydroflavonol 4-reductase1.1.1.2190.445
3b8z294A disintegrin and metalloproteinase with thrombospondin motifs 53.4.240.445
3vyeVYERenin3.4.23.150.445
4awmKDHPolymerase acidic protein/0.445
4kc1WS1Histo-blood group ABO system transferase/0.445
5il2SAHN6-adenosine-methyltransferase 70 kDa subunit/0.445
1eveE20Acetylcholinesterase3.1.1.70.444
1tcoFK5Peptidyl-prolyl cis-trans isomerase FKBP1A5.2.1.80.444
1tcoFK5Serine/threonine-protein phosphatase 2B catalytic subunit alpha isoform3.1.3.160.444
2b53D23Cyclin-dependent kinase 22.7.11.220.444
2e07SAHDiphthine synthase/0.444
2owfSAHDiphthine synthase/0.444
2wzySQXSoluble acetylcholine receptor/0.444
2y1wSFGHistone-arginine methyltransferase CARM1/0.444
3gytDL4Nuclear hormone receptor of the steroid/thyroid hormone receptors superfamily/0.444
3ko8NADNAD-dependent epimerase/dehydratase/0.444
3lpiZ74Beta-secretase 13.4.23.460.444
4bfvZVVPantothenate kinase2.7.1.330.444
4h5cYS4Farnesyl pyrophosphate synthase2.5.1.100.444
4ho4THMGlucose-1-phosphate thymidylyltransferase/0.444
1mewXMPInosine-5'-monophosphate dehydrogenase/0.443
2egbSAHDiphthine synthase/0.443
2ojg19AMitogen-activated protein kinase 12.7.11.240.443
2v16C47Renin3.4.23.150.443
3fowIMHPurine nucleoside phosphorylase/0.443
3n71SFGHistone-lysine N-methyltransferase Smyd1/0.443
3pftFMNFlavin reductase/0.443
4b6s2HN3-dehydroquinate dehydratase4.2.1.100.443
4b7zQ4QAcetylcholinesterase3.1.1.70.443
4ja1NGHStromelysin-13.4.24.170.443
5cmx0G6Prothrombin3.4.21.50.443
1blzACVIsopenicillin N synthase1.21.3.10.442
1k4gAIQQueuine tRNA-ribosyltransferase2.4.2.290.442
1u33LM2Pancreatic alpha-amylase/0.442
1uhoVDNcGMP-specific 3',5'-cyclic phosphodiesterase/0.442
2c9bPUG6,7-dimethyl-8-ribityllumazine synthase2.5.1.780.442
2dxxSAHDiphthine synthase/0.442
2j9fTHV2-oxoisovalerate dehydrogenase subunit alpha, mitochondrial1.2.4.40.442
2j9fTHV2-oxoisovalerate dehydrogenase subunit beta, mitochondrial1.2.4.40.442
2w6cBM4Acetylcholinesterase3.1.1.70.442
2zs9ADPPantothenate kinase2.7.1.330.442
3af4GCPPantothenate kinase2.7.1.330.442
3qi4IBMHigh affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A/0.442
3qt62P0Mevalonate diphosphate decarboxylase/0.442
4rdiATPtRNA threonylcarbamoyladenosine dehydratase6.10.442
4wh3ATPN-acetylhexosamine 1-kinase2.7.1.1620.442
1ejiTHFSerine hydroxymethyltransferase, cytosolic/0.441
1gesFADGlutathione reductase1.8.1.70.441
1k4mNADNicotinate-nucleotide adenylyltransferase2.7.7.180.441
2clmF6FTryptophan synthase alpha chain/0.441
2g28TDKPyruvate dehydrogenase E1 component1.2.4.10.441
2huqSAHDiphthine synthase/0.441
3dufR1TPyruvate dehydrogenase E1 component subunit alpha1.2.4.10.441
3dufR1TPyruvate dehydrogenase E1 component subunit beta1.2.4.10.441
3fhxPLPPyridoxal kinase2.7.1.350.441
3lthUD1UDP-N-acetylglucosamine 1-carboxyvinyltransferase/0.441
3pm1ETHTH-type transcriptional regulator QacR/0.441
3rsv3RSBeta-secretase 13.4.23.460.441
3sqxANPATP-dependent RNA helicase MSS116, mitochondrial3.6.4.130.441
3uwlFOZThymidylate synthase/0.441
4d79ATPtRNA threonylcarbamoyladenosine dehydratase6.10.441
4r5wXAVPoly [ADP-ribose] polymerase 12.4.2.300.441
4xba5GPAprataxin-like protein30.441
5hwpCOAHydroxymethylglutaryl-CoA synthase/0.441
1gpuTHDTransketolase 12.2.1.10.440
1nbiSAMGlycine N-methyltransferase2.1.1.200.440
1o2g696Prothrombin3.4.21.50.440
1oc1ASVIsopenicillin N synthase1.21.3.10.440
1qoqIGPTryptophan synthase alpha chain/0.440
2egsSAHDiphthine synthase/0.440
2i65NADADP-ribosyl cyclase/cyclic ADP-ribose hydrolase 13.2.2.60.440
2nmtMIMGlycylpeptide N-tetradecanoyltransferase2.3.1.970.440
2q153MRBeta-secretase 13.4.23.460.440
2wd8VGFPteridine reductase/0.440
2wwjY28Lysine-specific demethylase 4A/0.440
3af0GDPPantothenate kinase2.7.1.330.440
3gb4D3MDdmC/0.440
4at0FADPossible succinate dehydrogenase/0.440
4f31KAIGlutamate receptor 3/0.440
4fhd0TTSpore photoproduct lyase/0.440
4g2j0WFHigh affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A/0.440
4nesUD1UDP-N-acetylglucosamine 2-epimerase5.1.3.140.440
4oe4NADDelta-1-pyrroline-5-carboxylate dehydrogenase, mitochondrial1.2.1.880.440
5ah5LSSLeucine--tRNA ligase/0.440
5dp2NAPCurF/0.440
5i39FADL-amino acid deaminase/0.440