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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
3t0zATPHeat shock protein HSP 90-alpha

Complex with similar cavities

PDB ID HET Uniprot Name EC Number Cavity
Similarity
Align
3t0zATPHeat shock protein HSP 90-alpha/1.000
4gqtADPHeat shock protein 90/0.643
3t10ACPHeat shock protein HSP 90-alpha/0.640
2yefANPHeat shock protein HSP 90-alpha/0.634
2byh2D7Heat shock protein HSP 90-alpha/0.632
4xcjADPHeat shock cognate 90 kDa protein/0.629
2xhtC0YHeat shock protein HSP 90-alpha/0.617
3t1kANPHeat shock protein HSP 90-alpha/0.614
1yc34BCHeat shock protein HSP 90-alpha/0.612
3t2sAGSHeat shock protein HSP 90-alpha/0.607
2xx213CATP-dependent molecular chaperone HSP82/0.600
4xclAGSHeat shock cognate 90 kDa protein/0.596
2xk2ADPHeat shock protein HSP 90-alpha/0.591
3ekrPY9Heat shock protein HSP 90-alpha/0.589
2o1uANPEndoplasmin/0.587
4bqjXKLHeat shock protein HSP 90-alpha/0.581
1amwADPATP-dependent molecular chaperone HSP82/0.580
1byqADPHeat shock protein HSP 90-alpha/0.580
2byi2DDHeat shock protein HSP 90-alpha/0.580
4ipeANPTNF receptor-associated protein 1/0.579
4jqlVJ6Heat shock protein HSP 90-alpha/0.578
3r4oFU3Heat shock protein HSP 90-alpha/0.569
2hchN5AEndoplasmin/0.566
1osfKOSHeat shock protein HSP 90-alpha/0.564
2fypRDEEndoplasmin/0.564
4ivgANPTNF receptor-associated protein 1/0.564
2fxsRDAATP-dependent molecular chaperone HSP82/0.561
4as94QSATP-dependent molecular chaperone HSP82/0.561
1yt0ADPEndoplasmin/0.560
2exlGDMEndoplasmin/0.560
2xcmADPCytosolic heat shock protein 90/0.555
4egiB2JHeat shock protein HSP 90-alpha/0.553
1u2oNECEndoplasmin/0.551
3r4pFU7Heat shock protein HSP 90-alpha/0.551
2iwuNP5ATP-dependent molecular chaperone HSP82/0.550
1am1ADPATP-dependent molecular chaperone HSP82/0.549
2o1vADPEndoplasmin/0.549
2xabVHDHeat shock protein HSP 90-alpha/0.547
2yegXQGHeat shock protein HSP 90-alpha/0.546
1yetGDMHeat shock protein HSP 90-alpha/0.544
2bu8ADP[Pyruvate dehydrogenase (acetyl-transferring)] kinase isozyme 2, mitochondrial2.7.11.20.544
3vhaVHAHeat shock protein HSP 90-alpha/0.544
4xc0ACPHeat shock cognate 90 kDa protein/0.544
5f5rANPHeat shock protein 75 kDa, mitochondrial/0.544
4ce17FKATP-dependent molecular chaperone HSP82/0.542
4fcr0TMHeat shock protein HSP 90-alpha/0.541
3hhu819Heat shock protein HSP 90-alpha/0.540
1i59ANPChemotaxis protein CheA2.7.13.30.537
2xjjL81Heat shock protein HSP 90-alpha/0.537
3iedAN2HSP90/0.537
1y4sADPChaperone protein HtpG/0.536
2qg0A94Heat shock protein HSP 90-alpha/0.535
1yc14BCHeat shock protein HSP 90-alpha/0.533
3ekoPYUHeat shock protein HSP 90-alpha/0.533
3k99PFTHeat shock protein HSP 90-alpha/0.533
4asf62UATP-dependent molecular chaperone HSP82/0.533
1u0yPA7Endoplasmin/0.532
1bgqRDCATP-dependent molecular chaperone HSP82/0.530
2esaGDMEndoplasmin/0.530
1qy8RDIEndoplasmin/0.529
2bt0CT5Heat shock protein HSP 90-alpha/0.529
1u0zRDCEndoplasmin/0.527
2hg1N5OEndoplasmin/0.527
3rlq3RQHeat shock protein HSP 90-alpha/0.527
2gfdRDAEndoplasmin/0.525
3pehIBDEndoplasmin homolog, putative/0.525
4ce2BO5ATP-dependent molecular chaperone HSP82/0.525
2werRDCATP-dependent molecular chaperone HSP82/0.524
2zdyADP[Pyruvate dehydrogenase (acetyl-transferring)] kinase isozyme 4, mitochondrial2.7.11.20.523
3d2rADP[Pyruvate dehydrogenase (acetyl-transferring)] kinase isozyme 4, mitochondrial2.7.11.20.522
3whaWHAHeat shock protein HSP 90-alpha/0.522
4asg814ATP-dependent molecular chaperone HSP82/0.522
1yszNECEndoplasmin/0.521
2gqpPA7Endoplasmin/0.521
3crlANP[Pyruvate dehydrogenase (acetyl-transferring)] kinase isozyme 2, mitochondrial2.7.11.20.520
2breKJ2ATP-dependent molecular chaperone HSP82/0.519
3k981RCHeat shock protein HSP 90-alpha/0.519
3rlr3RRHeat shock protein HSP 90-alpha/0.517
2qfoA13Heat shock protein HSP 90-alpha/0.516
2brcCT5ATP-dependent molecular chaperone HSP82/0.515
3k974CDHeat shock protein HSP 90-alpha/0.515
4bqg50QHeat shock protein HSP 90-alpha/0.515
2e0aANP[Pyruvate dehydrogenase (acetyl-transferring)] kinase isozyme 4, mitochondrial2.7.11.20.514
2wepADPATP-dependent molecular chaperone HSP82/0.512
4eftEFTHeat shock protein HSP 90-alpha/0.509
2vw5BC6ATP-dependent molecular chaperone HSP82/0.508
3hyz42CHeat shock protein HSP 90-alpha/0.508
1qy5NECEndoplasmin/0.506
1uy7PU4Heat shock protein HSP 90-alpha/0.506
1uyePU9Heat shock protein HSP 90-alpha/0.506
3r4nFU5Heat shock protein HSP 90-alpha/0.506
2vwcBC2ATP-dependent molecular chaperone HSP82/0.504
2yee2ECHeat shock protein HSP 90-alpha/0.503
4egkRDCHeat shock protein HSP 90-alpha/0.503
2bz5AB4Heat shock protein HSP 90-alpha/0.500
2wi6ZZ6Heat shock protein HSP 90-alpha/0.500
1yc443PHeat shock protein HSP 90-alpha/0.498
2iwsNP4ATP-dependent molecular chaperone HSP82/0.498
2vcj2EQHeat shock protein HSP 90-alpha/0.497
2xd6XD6ATP-dependent molecular chaperone HSP82/0.497
2wi5ZZ5Heat shock protein HSP 90-alpha/0.496
4ce3L4VATP-dependent molecular chaperone HSP82/0.496
2qfoA51Heat shock protein HSP 90-alpha/0.495
3q5lKX2Heat shock protein 83-1/0.495
1uykPUXHeat shock protein HSP 90-alpha/0.494
2cgfP2NATP-dependent molecular chaperone HSP82/0.494
2zkjADP[Pyruvate dehydrogenase (acetyl-transferring)] kinase isozyme 4, mitochondrial2.7.11.20.494
1i5aACPChemotaxis protein CheA2.7.13.30.493
1uy8PU5Heat shock protein HSP 90-alpha/0.492
2xhrC0PHeat shock protein HSP 90-alpha/0.492
4hy6FJ1Heat shock protein HSP 90-alpha/0.490
3hz5Z64Heat shock protein HSP 90-alpha/0.489
3qdd94MHeat shock protein HSP 90-alpha/0.489
2wi72KLHeat shock protein HSP 90-alpha/0.488
2yi5YI5Heat shock protein HSP 90-alpha/0.487
3d0bSNXHeat shock protein HSP 90-alpha/0.486
1uy9PU6Heat shock protein HSP 90-alpha/0.485
3hz142CHeat shock protein HSP 90-alpha/0.485
3ft8MOJHeat shock protein HSP 90-alpha/0.484
4efuEFUHeat shock protein HSP 90-alpha/0.484
4egh0OYHeat shock protein HSP 90-alpha/0.483
1uyhPU0Heat shock protein HSP 90-alpha/0.481
2yeiXQIHeat shock protein HSP 90-alpha/0.481
3c11GDMATP-dependent molecular chaperone HSP82/0.480
2bu2ATP[Pyruvate dehydrogenase (acetyl-transferring)] kinase isozyme 2, mitochondrial2.7.11.20.479
2xx413IATP-dependent molecular chaperone HSP82/0.479
3b28B2XHeat shock protein HSP 90-alpha/0.479
3hz137DHeat shock protein HSP 90-alpha/0.479
2fwyH64Heat shock protein HSP 90-alpha/0.478
1uydPU8Heat shock protein HSP 90-alpha/0.476
2vci2GJHeat shock protein HSP 90-alpha/0.476
2yxuATPPyridoxal kinase2.7.1.350.476
4fcq2N6Heat shock protein HSP 90-alpha/0.476
1uy6PU3Heat shock protein HSP 90-alpha/0.475
1i58ADPChemotaxis protein CheA2.7.13.30.474
1uymPU3Heat shock protein HSP 90-beta/0.474
2yk2YJXHeat shock protein HSP 90-alpha/0.474
2c2aADPSensor histidine kinase/0.473
1i5cADPChemotaxis protein CheA2.7.13.30.472
1ny3ADPMAP kinase-activated protein kinase 22.7.11.10.470
3q5kD1UHeat shock protein 83-1/0.470
1towCRZFatty acid-binding protein, adipocyte/0.469
2uwd2GGHeat shock protein HSP 90-alpha/0.469
2zbaZBATrichothecene 3-O-acetyltransferase/0.469
2wi1ZZ2Heat shock protein HSP 90-alpha/0.468
3hekBD0Heat shock protein HSP 90-alpha/0.468
5a9sNAPPutative dehydrogenase/0.468
1i58ACPChemotaxis protein CheA2.7.13.30.466
4fmxCNL1,8-cineole 2-endo-monooxygenase1.14.13.1560.466
1uyiPUZHeat shock protein HSP 90-alpha/0.465
2v4lABJPhosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform2.7.1.1530.464
2yecXQ0Heat shock protein HSP 90-alpha/0.464
3mnrSD1Heat shock protein HSP 90-alpha/0.464
3pejBC2Endoplasmin homolog, putative/0.464
1z59ADPType 2 DNA topoisomerase 6 subunit B/0.463
2cchATPCyclin-dependent kinase 22.7.11.220.463
2iwxM1SATP-dependent molecular chaperone HSP82/0.463
1nhhANPDNA mismatch repair protein MutL/0.462
1jm6ADP[Pyruvate dehydrogenase (acetyl-transferring)] kinase isozyme 2, mitochondrial2.7.11.20.461
2bsmBSMHeat shock protein HSP 90-alpha/0.461
2wi4ZZ4Heat shock protein HSP 90-alpha/0.461
2ye42FYHeat shock protein HSP 90-alpha/0.461
2ykjYKJHeat shock protein HSP 90-alpha/0.461
4lhtCNL1,8-cineole 2-endo-monooxygenase1.14.13.1560.461
2fwzH71Heat shock protein HSP 90-alpha/0.460
2qg2A91Heat shock protein HSP 90-alpha/0.460
2yejXQKHeat shock protein HSP 90-alpha/0.460
2yi66QMHeat shock protein HSP 90-alpha/0.460
3inwJZBHeat shock protein HSP 90-alpha/0.460
3u9eCOALmo1369 protein/0.460
4awq592Heat shock protein HSP 90-alpha/0.460
4fl2ANPTyrosine-protein kinase SYK2.7.10.20.460
1nzdUPGDNA beta-glucosyltransferase/0.459
3kb1ADPIron-sulfur cluster carrier protein/0.459
5c03AGSNon-receptor tyrosine-protein kinase TYK22.7.10.20.459
3cukFADD-amino-acid oxidase1.4.3.30.458
4l6gCNL1,8-cineole 2-endo-monooxygenase1.14.13.1560.458
1e90MYCPhosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform2.7.1.1530.457
1i59ADPChemotaxis protein CheA2.7.13.30.457
1mx0ANPType 2 DNA topoisomerase 6 subunit B/0.456
4yduADPtRNA N6-adenosine threonylcarbamoyltransferase/0.456
1i5bANPChemotaxis protein CheA2.7.13.30.455
4c9oCAMCytochrome P450/0.455
4du82P0Mevalonate diphosphate decarboxylase/0.453
4k28NADShikimate dehydrogenase family protein/0.453
1b38ATPCyclin-dependent kinase 22.7.11.220.452
1pjcNADAlanine dehydrogenase/0.452
2briANPUridylate kinase2.7.4.220.452
2yjwYJWHeat shock protein HSP 90-alpha/0.452
1nzfUPGDNA beta-glucosyltransferase/0.451
2aqhNAIEnoyl-[acyl-carrier-protein] reductase [NADH]1.3.1.90.451
2cf6NAPCinnamyl alcohol dehydrogenase 51.1.1.1950.451
3lshFADPyranose 2-oxidase/0.451
3w2nRODDihydroorotate dehydrogenase (fumarate)1.3.98.10.451
4ic7ANPMitogen-activated protein kinase 72.7.11.240.451
4l4bCAMCamphor 5-monooxygenase1.14.15.10.451
4l4cCAMCamphor 5-monooxygenase1.14.15.10.451
3a99ANPSerine/threonine-protein kinase pim-12.7.11.10.450
3rukAERSteroid 17-alpha-hydroxylase/17,20 lyase/0.450
4xfjANPArgininosuccinate synthase/0.450
1t2bCNL1,8-cineole 2-endo-monooxygenase1.14.13.1560.449
2cig1DGDihydrofolate reductase1.5.1.30.449
2oorNADNAD(P) transhydrogenase subunit alpha part 11.6.1.20.449
2zdxP4A[Pyruvate dehydrogenase (acetyl-transferring)] kinase isozyme 4, mitochondrial2.7.11.20.449
3inxJZCHeat shock protein HSP 90-alpha/0.449
4bcoT6QCyclin-dependent kinase 22.7.11.220.449
6cp4CAMCamphor 5-monooxygenase1.14.15.10.449
1hk2T44Serum albumin/0.448
2qo9ANPEphrin type-A receptor 32.7.10.10.448
2v7a627Tyrosine-protein kinase ABL12.7.10.20.447
3e8cG96cAMP-dependent protein kinase catalytic subunit alpha2.7.11.110.447
4k33ACPFibroblast growth factor receptor 32.7.10.10.447
5awmANPStress-activated protein kinase JNK2.7.11.240.447
2izsBRQCasein kinase I isoform gamma-32.7.11.10.446
3dds26BGlycogen phosphorylase, liver form2.4.1.10.446
3flsFLSMitogen-activated protein kinase 14/0.446
4cp4CAMCamphor 5-monooxygenase1.14.15.10.446
4z63ILE_THR_GLN_TYS_TYSPhytosulfokine receptor 12.7.11.10.446
1x1cSAHC-20 methyltransferase/0.445
3keuATPPyridoxal kinase2.7.1.350.445
4l4aCAMCamphor 5-monooxygenase1.14.15.10.445
1dz8CAMCamphor 5-monooxygenase1.14.15.10.444
1ir3ANPInsulin receptor2.7.10.10.444
2pdtFADVivid PAS protein VVD/0.444
2rhrEMOPutative ketoacyl reductase1.3.10.444
3crzFADFerredoxin--NADP+ reductase/0.444
3s1dZIRCytokinin dehydrogenase 11.5.99.120.444
3tjsD0RCytochrome P450 3A4/0.444
4hjfC2EGGDEF family protein/0.444
1dz6CAMCamphor 5-monooxygenase1.14.15.10.443
2a1oCAMCamphor 5-monooxygenase1.14.15.10.443
2m56CAMCamphor 5-monooxygenase1.14.15.10.443
2nliFMNLactate oxidase/0.443
2yyuC5POrotidine 5'-phosphate decarboxylase/0.443
3a0tADPSensor histidine kinase/0.443
4duhRLIDNA gyrase subunit B/0.443
4fduIHSPutative multiple inositol polyphosphate histidine phosphatase 1/0.443
4nmdFDABifunctional protein PutA/0.443
1kvuUPGUDP-glucose 4-epimerase5.1.3.20.442
1np7FADCryptochrome DASH/0.442
1ol5ADPAurora kinase A2.7.11.10.442
2chtTSAChorismate mutase AroH5.4.99.50.442
3frqERYErythromycin resistance repressor protein/0.442
3nguADPNucleoside diphosphate kinase/0.442
3oeyNADEnoyl-[acyl-carrier-protein] reductase [NADH]1.3.1.90.442
3r83Z14Cyclin-dependent kinase 22.7.11.220.442
4fad0TBPhosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform2.7.1.1530.442
4ii5ADPCyclin-dependent kinase 22.7.11.220.442
4pl9ADPEthylene receptor 1/0.442
1ao0ADPAmidophosphoribosyltransferase/0.441
1os1ATPPhosphoenolpyruvate carboxykinase (ATP)/0.441
3dd125DGlycogen phosphorylase, liver form2.4.1.10.441
3wrjCAMCamphor 5-monooxygenase1.14.15.10.441
4gb90WRPhosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform2.7.1.1530.441
4k9yK9YFocal adhesion kinase 12.7.10.20.441
4xgxADPFAD:protein FMN transferase/0.441
1enyNADEnoyl-[acyl-carrier-protein] reductase [NADH]1.3.1.90.440
1qxoFMNChorismate synthase/0.440
1rx1NAPDihydrofolate reductase1.5.1.30.440
2b9fADPMitogen-activated protein kinase FUS32.7.11.240.440
3cppCAMCamphor 5-monooxygenase1.14.15.10.440
4bcnT9NCyclin-dependent kinase 22.7.11.220.440
4hle17VPhosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform2.7.1.1530.440