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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
1flsWAYCollagenase 33.4.24

Complex with similar cavities

PDB ID HET Uniprot Name EC Number Cavity
Similarity
Align
1flsWAYCollagenase 33.4.241.000
1fm1WAYCollagenase 33.4.240.694
1x8lOXRRetinol dehydratase/0.511
1rt9IMHPurine nucleoside phosphorylase2.4.2.10.503
1jk3BATMacrophage metalloelastase3.4.24.650.496
3aykCGSInterstitial collagenase3.4.24.70.492
3b8z294A disintegrin and metalloproteinase with thrombospondin motifs 53.4.240.491
2ji7ADPOxalyl-CoA decarboxylase4.1.1.80.490
1fmjRTLRetinol dehydratase/0.484
1fmlRTLRetinol dehydratase/0.484
2hkoFADLysine-specific histone demethylase 1A10.482
3zkyWT4Isopenicillin N synthase1.21.3.10.482
4g8jTHMUridine phosphorylase/0.478
1bk0ACVIsopenicillin N synthase1.21.3.10.476
1g4kHQQStromelysin-13.4.24.170.476
2x06NADL-sulfolactate dehydrogenase/0.476
4rvnCOAPhenylacetate-coenzyme A ligase/0.475
3b1dPLSBetaC-S lyase/0.474
1x2hLPALipoate-protein ligase A6.3.1.200.472
2p8uCOAHydroxymethylglutaryl-CoA synthase, cytoplasmic2.3.3.100.472
3br3ETHTH-type transcriptional regulator QacR/0.472
1hv5RXPStromelysin-33.4.240.471
1s0xC3SNuclear receptor ROR-alpha/0.471
3dh7FMNIsopentenyl-diphosphate delta-isomerase/0.471
3hz6ADPXylulokinase/0.471
2iviACWIsopenicillin N synthase1.21.3.10.470
3gmd2M3Corticosteroid 11-beta-dehydrogenase isozyme 11.1.1.1460.470
4ubvCOASteroid 3-ketoacyl-CoA thiolase/0.470
1b2lNDCAlcohol dehydrogenase1.1.1.10.469
1mv8GDXGDP-mannose 6-dehydrogenase1.1.1.1320.469
1rr6IMHPurine nucleoside phosphorylase2.4.2.10.469
2srtINHStromelysin-13.4.24.170.469
1rm8BATMatrix metalloproteinase-163.4.240.468
2o1xTDP1-deoxy-D-xylulose-5-phosphate synthase2.2.1.70.467
2yg5FADPutrescine oxidase/0.467
2zs8ADPPantothenate kinase2.7.1.330.467
3akzGSUGlutamate--tRNA ligase 2/0.467
4j531J4Serine/threonine-protein kinase PLK12.7.11.210.467
1gjrFADFerredoxin--NADP reductase1.18.1.20.466
2e16SAHDiphthine synthase/0.466
3aig0ZCSnake venom metalloproteinase adamalysin-23.4.24.460.466
3eheNADUDP-glucose 4-epimerase (GalE-1)/0.466
1bzsBSINeutrophil collagenase3.4.24.340.465
1v3q2DIPurine nucleoside phosphorylase2.4.2.10.465
2vcmM11Isopenicillin N synthase1.21.3.10.465
3bi6396Wee1-like protein kinase2.7.10.20.465
3exhTPPPyruvate dehydrogenase E1 component subunit alpha, somatic form, mitochondrial1.2.4.10.465
3exhTPPPyruvate dehydrogenase E1 component subunit beta, mitochondrial1.2.4.10.465
3hy9098A disintegrin and metalloproteinase with thrombospondin motifs 53.4.240.465
1rszDIHPurine nucleoside phosphorylase2.4.2.10.464
3fhxPLPPyridoxal kinase2.7.1.350.464
4u0mGTPCyclic GMP-AMP synthase/0.464
1u1f183Uridine phosphorylase2.4.2.30.463
2dsgSAHDiphthine synthase/0.463
3bi2FADPolyamine oxidase FMS1/0.463
4hfr14MCorticosteroid 11-beta-dehydrogenase isozyme 11.1.1.1460.463
4xo7ASDAldo-keto reductase family 1 member C2/0.463
2g1n1IGRenin3.4.23.150.462
2xs3ALA_PHE_THR_SERKarilysin3.4.240.462
1qgyFADFerredoxin--NADP reductase1.18.1.20.461
2gfxPMN3-oxoacyl-[acyl-carrier-protein] synthase 22.3.1.1790.461
3hy7097A disintegrin and metalloproteinase with thrombospondin motifs 53.4.240.461
1hb1OCVIsopenicillin N synthase1.21.3.10.460
2wo7ASVIsopenicillin N synthase1.21.3.10.460
3atzFMNProstaglandin F2a synthase/0.460
3u8l09QAcetylcholine-binding protein/0.460
3lzwNAPFerredoxin--NADP reductase 21.18.1.20.459
3oiaA31Camphor 5-monooxygenase1.14.15.10.459
3zoiM2WIsopenicillin N synthase1.21.3.10.459
1t0iFMNNAD(P)H-dependent FMN reductase LOT6/0.458
2gevCOKPantothenate kinase2.7.1.330.458
2yoj8Y6Genome polyprotein2.7.7.480.458
3dvaTPWPyruvate dehydrogenase E1 component subunit alpha1.2.4.10.458
3dvaTPWPyruvate dehydrogenase E1 component subunit beta1.2.4.10.458
3ljtLA3A disintegrin and metalloproteinase with thrombospondin motifs 53.4.240.458
4aykCGSInterstitial collagenase3.4.24.70.458
5bt9NAP3-oxoacyl-(Acyl-carrier-protein) reductase/0.458
3mhpFADFerredoxin--NADP reductase, leaf isozyme, chloroplastic1.18.1.20.457
3ndjJHZMethyltransferase/0.457
4xbfFADLysine-specific histone demethylase 1A10.457
2a0yDIHPurine nucleoside phosphorylase2.4.2.10.456
4bfvZVVPantothenate kinase2.7.1.330.456
1hb3SCVIsopenicillin N synthase1.21.3.10.455
1qiqACCIsopenicillin N synthase1.21.3.10.455
2e0nSAHPrecorrin-2 C20-methyltransferase/0.455
2ejzSAHDiphthine synthase/0.455
2nnqT4BFatty acid-binding protein, adipocyte/0.455
2vbdV10Isopenicillin N synthase1.21.3.10.455
3eksCY9Actin-5C/0.455
3wqtANPCell division protein FtsA/0.455
5dp2NAPCurF/0.455
1obnASVIsopenicillin N synthase1.21.3.10.454
1x1cSAHC-20 methyltransferase/0.454
2a5kAZPReplicase polyprotein 1ab3.4.220.454
2tscCB3Thymidylate synthase/0.454
4b66NAPL-ornithine N(5)-monooxygenase/0.454
4bb3KKAIsopenicillin N synthase1.21.3.10.454
2a0wDIHPurine nucleoside phosphorylase2.4.2.10.453
2p6lSAHDiphthine synthase/0.453
2vkeTACTetracycline repressor protein class D/0.453
3juqAJDPhenazine biosynthesis protein A/B/0.453
4jeyPLPAcetylornithine/succinyldiaminopimelate aminotransferase2.6.1.110.453
1ay0TPPTransketolase 12.2.1.10.452
2wyaHMGHydroxymethylglutaryl-CoA synthase, mitochondrial2.3.3.100.452
3q9bB3NAcetylpolyamine amidohydrolase/0.452
1zxmANPDNA topoisomerase 2-alpha5.99.1.30.451
2eglSAHDiphthine synthase/0.451
2g8yNADHydroxycarboxylate dehydrogenase B/0.451
3fr5I4AFatty acid-binding protein, adipocyte/0.451
3jsiWTCHigh affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A/0.451
3pm1ETHTH-type transcriptional regulator QacR/0.451
3tr05GPGuanylate kinase/0.451
2ed5SAHDiphthine synthase/0.450
2in6839Wee1-like protein kinase2.7.10.20.450
2npiATPmRNA cleavage and polyadenylation factor CLP1/0.450
2xviFADPutative flavin-containing monooxygenase/0.450
2yg4FADPutrescine oxidase/0.450
3pqbVGPPutative oxidoreductase/0.450
3qgf46FGenome polyprotein2.7.7.480.450
3uph0C1Genome polyprotein2.7.7.480.450
3uzwNAP3-oxo-5-beta-steroid 4-dehydrogenase/0.450
4e32DWNMethyltransferase/0.450
1pwyAC2Purine nucleoside phosphorylase2.4.2.10.449
2cgw3C3Serine/threonine-protein kinase Chk12.7.11.10.449
2gjnFMNNitronate monooxygenase1.13.12.160.449
2gvdFKPAdenylate cyclase type 2/0.449
2gvdFKPAdenylate cyclase type 5/0.449
3fsjD7KBenzoylformate decarboxylase4.1.1.70.449
3ozd4CTS-methyl-5'-thioadenosine phosphorylase/0.449
3pe2E1BCasein kinase II subunit alpha2.7.11.10.449
3sff0DIHistone deacetylase 83.5.1.980.449
4b63NAPL-ornithine N(5)-monooxygenase/0.449
1lf2R37Plasmepsin-23.4.23.390.448
1v93FADMethylenetetrahydrofolate reductase/0.448
2yphQQY2',3'-cyclic-nucleotide 3'-phosphodiesterase3.1.4.370.448
2zsiGA4Gibberellin receptor GID1A30.448
3atyFMNProstaglandin F2a synthase/0.448
3fktSIIBeta-secretase 13.4.23.460.448
3fr4F8AFatty acid-binding protein, adipocyte/0.448
3kmeINNDisintegrin and metalloproteinase domain-containing protein 173.4.24.860.448
4c36ZO9cAMP-dependent protein kinase catalytic subunit alpha2.7.11.110.448
4cjx9L9C-1-tetrahydrofolate synthase, cytoplasmic, putative/0.448
4obuPLPPyridoxal-dependent decarboxylase domain protein/0.448
4zzi1NSNAD-dependent protein deacetylase sirtuin-13.5.10.448
1a72PADAlcohol dehydrogenase E chain1.1.1.10.447
1atl0QISnake venom metalloproteinase atrolysin-D3.4.24.420.447
1lwiNAP3-alpha-hydroxysteroid dehydrogenase1.1.1.500.447
1oc1ASVIsopenicillin N synthase1.21.3.10.447
1rx1NAPDihydrofolate reductase1.5.1.30.447
1sd2MTHS-methyl-5'-thioadenosine phosphorylase/0.447
1t13INI6,7-dimethyl-8-ribityllumazine synthase 2/0.447
2bu9HFVIsopenicillin N synthase1.21.3.10.447
2o1sTDP1-deoxy-D-xylulose-5-phosphate synthase2.2.1.70.447
2obxINI6,7-dimethyl-8-ribityllumazine synthase 22.5.1.780.447
2y60M8FIsopenicillin N synthase1.21.3.10.447
4bfwZVWPantothenate kinase2.7.1.330.447
4bfxZVXPantothenate kinase2.7.1.330.447
4i6h1C8Serine/threonine-protein kinase PLK22.7.11.210.447
1ja1FADNADPH--cytochrome P450 reductase/0.446
1t4cCOAFormyl-CoA:oxalate CoA-transferase/0.446
2gjlFMNNitronate monooxygenase1.13.12.160.446
2wd8VGFPteridine reductase/0.446
2zatNAPDehydrogenase/reductase SDR family member 41.1.1.1840.446
3adaNADSubunit alpha of sarocosine oxidase/0.446
3bi5FADPolyamine oxidase FMS1/0.446
3fufBESLeukotriene A-4 hydrolase3.3.2.60.446
3p80P80Pentaerythritol tetranitrate reductase/0.446
3tqxPLP2-amino-3-ketobutyrate coenzyme A ligase/0.446
4c72TLG3-oxoacyl-ACP synthase/0.446
4j1k1HGBeta-secretase 13.4.23.460.446
4l1xNAPAldo-keto reductase family 1 member C2/0.446
1d3dBZTProthrombin3.4.21.50.445
1kuyCOTSerotonin N-acetyltransferase/0.445
1zgv501Prothrombin3.4.21.50.445
2yg3FADPutrescine oxidase/0.445
3ebiBEYM1 family aminopeptidase3.4.110.445
3fhxPXLPyridoxal kinase2.7.1.350.445
3h1vTK1Glucokinase2.7.1.20.445
4a959MTGlycylpeptide N-tetradecanoyltransferase/0.445
4j491J1Uncharacterized protein/0.445
4je5PLPAromatic/aminoadipate aminotransferase 12.6.1.390.445
4xbjIN5Alanine racemase, biosynthetic/0.445
1enoNADEnoyl-[acyl-carrier-protein] reductase [NADH], chloroplastic1.3.1.90.444
2clfF6FTryptophan synthase alpha chain/0.444
2nmtMIMGlycylpeptide N-tetradecanoyltransferase2.3.1.970.444
2pzjNADPutative nucleotide sugar epimerase/ dehydratase/0.444
2xvv9DNSerum albumin/0.444
2zdyADP[Pyruvate dehydrogenase (acetyl-transferring)] kinase isozyme 4, mitochondrial2.7.11.20.444
3dynPCGHigh affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A/0.444
3ha5SFGHydroxymycolate synthase MmaA42.1.10.444
4n4v2GYTankyrase-12.4.2.300.444
4rtbSAMPutative thiazole biosynthesis protein ThiH/0.444
4v2gITCTetracycline repressor protein class D/0.444
1ewyFADFerredoxin--NADP reductase1.18.1.20.443
1zisINI6,7-dimethyl-8-ribityllumazine synthase2.5.1.780.443
1zxnADPDNA topoisomerase 2-alpha5.99.1.30.443
2dxwSAHDiphthine synthase/0.443
2hxdDUPdCTP deaminase, dUMP-forming3.5.4.300.443
2y05RALProstaglandin reductase 1/0.443
2ym1FADPhenylacetone monooxygenase1.14.13.920.443
2yy2IBMHigh affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A/0.443
2z7hGG3Geranylgeranyl pyrophosphate synthase/0.443
3kr6UD1UDP-N-acetylglucosamine 1-carboxyvinyltransferase/0.443
3pndFADFAD:protein FMN transferase/0.443
3zg6APRNAD-dependent protein deacetylase sirtuin-63.5.10.443
4e2dFMNDehydrogenase/0.443
4e5yNDPGDP-L-fucose synthase1.1.1.2710.443
4obwSAM2-methoxy-6-polyprenyl-1,4-benzoquinol methylase, mitochondrial/0.443
1bx1FADFerredoxin--NADP reductase, chloroplastic1.18.1.20.442
1cjwCOTSerotonin N-acetyltransferase/0.442
1m4iCOAAminoglycoside 2'-N-acetyltransferase2.3.10.442
1thnADPAnti-sigma F factor/0.442
1x8b824Wee1-like protein kinase2.7.10.20.442
2ewmNAD(S)-1-Phenylethanol dehydrogenase1.1.1.3110.442
2vbpVB1Isopenicillin N synthase1.21.3.10.442
2y6fM9FIsopenicillin N synthase1.21.3.10.442
3flkNAITartrate dehydrogenase/decarboxylase1.1.1.930.442
3hkoANPCalcium/calmodulin-dependent protein kinase with a kinase domain and 2 calmodulin-like EF hands/0.442
3ske054Genome polyprotein2.7.7.480.442
4eplJAIJasmonic acid-amido synthetase JAR16.3.20.442
1mrkFMCRibosome-inactivating protein alpha-trichosanthin3.2.2.220.441
1yqzCOACoenzyme A disulfide reductase/0.441
2i47KGYDisintegrin and metalloproteinase domain-containing protein 173.4.24.860.441
2jb4A14Isopenicillin N synthase1.21.3.10.441
3dyqPCGHigh affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A/0.441
3gnvXNZGenome polyprotein2.7.7.480.441
3sqzCOAPutative hydroxymethylglutaryl-CoA synthase/0.441
4ajfF03cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A3.1.4.170.441
4e907RGHigh affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A/0.441
4eph0RKCarnitine O-palmitoyltransferase 2, mitochondrial2.3.1.210.441
4j3mAJ8Tankyrase-22.4.2.300.441
1bjkFADFerredoxin--NADP reductase1.18.1.20.440
1d7xSPCStromelysin-13.4.24.170.440
1g1aNADdTDP-glucose 4,6-dehydratase/0.440
1xs7MMIBeta-secretase 13.4.23.460.440
2bvs2CEProthrombin3.4.21.50.440
2e07SAHDiphthine synthase/0.440
2el0SAHDiphthine synthase/0.440
2pb4SAHDiphthine synthase/0.440
2zshGA3Gibberellin receptor GID1A30.440
3hgoFMN12-oxophytodienoate reductase 31.3.1.420.440
3i0pNADMalate dehydrogenase, putative/0.440
3mjeNDPAmphB/0.440
3orfNADDihydropteridine reductase1.5.1.340.440
3qgi33FGenome polyprotein2.7.7.480.440
4a16H34Acetylcholinesterase3.1.1.70.440
4e2yJHZMethyltransferase/0.440
4exg916Beta-secretase 13.4.23.460.440
4f7iNAD3-isopropylmalate dehydrogenase1.1.1.850.440
4y7cFMNNADPH--cytochrome P450 reductase/0.440