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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
3litE15Protease

Complex with similar cavities

PDB ID HET Uniprot Name EC Number Cavity
Similarity
Align
3litE15Protease/1.000
3liqE14Protease/0.750
3livE16Protease/0.740
3linE13Protease/0.644
3wsjMK1Protease/0.580
2xyfG40Gag-Pol polyprotein/0.527
3ekp478Gag-Pol polyprotein3.4.23.160.515
1hvjA78Gag-Pol polyprotein/0.512
1w5yBE6Gag-Pol polyprotein3.4.23.160.506
1rl8RITGag-Pol polyprotein3.4.23.160.505
2aoe0Q4Gag-Pol polyprotein3.4.23.160.502
3em4DR7Gag-Pol polyprotein3.4.23.160.502
2fxeDR7Gag-Pol polyprotein3.4.23.160.500
3ggaGGWGag-Pol polyprotein/0.498
3lixE17Protease/0.498
2xyeCXGGag-Pol polyprotein/0.497
3ggxGGXGag-Pol polyprotein/0.497
1difA85Gag-Pol polyprotein/0.496
2cem2AHPol protein/0.496
2nnkROCProtease/0.496
3kdcJZPGag-Pol polyprotein3.4.23.160.496
3ekqROCGag-Pol polyprotein3.4.23.160.495
1hvlA76Gag-Pol polyprotein/0.494
1hvsA77Gag-Pol polyprotein/0.494
2ieo017Protease/0.494
3bgbLJGGag-Pol polyprotein3.4.23.160.494
3el51UNGag-Pol polyprotein/0.494
1ivp1ZKGag-Pol polyprotein/0.492
1wbk568Pol protein/0.492
3ekwDR7Gag-Pol polyprotein3.4.23.160.492
4a4qUX9Pol protein/0.492
2aquDR7Gag-Pol polyprotein3.4.23.160.491
2pk6O33V-1 protease/0.491
2uy0HV1Gag-Pol polyprotein3.4.23.160.491
4djr0KJPol polyprotein/0.491
4njvRITProtease/0.491
2p3b3TLV-1 PROTEASE protein/0.490
2p3b3TLV-1 protease/0.490
4a6cQG9Gag-Pol polyprotein3.4.23.160.490
4hdfG52Gag-Pol polyprotein3.4.23.160.490
1bv7XV6Gag-Pol polyprotein3.4.23.160.489
1d4yTPVGag-Pol polyprotein3.4.23.160.489
3kfr3TLGag-Pol polyprotein/0.489
3zptM8YGag-Pol polyprotein3.4.23.160.489
1vikBAYGag-Pol polyprotein/0.488
2cen4AHProtease/0.488
3sa755AProtease/0.488
2qi3MZ5Gag-Pol polyprotein/0.487
1ec2BEJGag-Pol polyprotein3.4.23.160.486
2rkfAB1Pol protein/0.486
3bxsDRSGag-Pol polyprotein3.4.23.160.486
3nxe2NCProtease/0.486
4kb9G79Protease/0.486
1ohr1UNV-1 PROTEASE protein/0.485
1t7i017Gag-Pol polyprotein3.4.23.160.485
2bqvA1AProtease/0.485
3zpsEQMGag-Pol polyprotein3.4.23.160.485
2fdd385Pol protein/0.484
4a6bQG8Gag-Pol polyprotein3.4.23.160.484
1hpxKNIGag-Pol polyprotein/0.483
2fxdDR7Pol polyprotein/0.482
3ndxRITGag-Pol polyprotein3.4.23.160.482
4djoMK5Pol polyprotein/0.482
1ec3MS3Gag-Pol polyprotein3.4.23.160.481
1hxbROCGag-Pol polyprotein3.4.23.160.481
2f3kRO1Protease/0.481
3kf03TLGag-Pol polyprotein/0.481
4ye3G04Gag-Pol polyprotein3.4.23.160.481
1k2b0Q4Gag-Pol polyprotein3.4.23.160.480
2nmyROCProtease/0.480
3ndwRITGag-Pol polyprotein3.4.23.160.480
1a9mU0EGag-Pol polyprotein/0.478
1hvkA79Gag-Pol polyprotein/0.478
3fx5KNIGag-Pol polyprotein3.4.23.160.478
3ndtROCGag-Pol polyprotein3.4.23.160.478
2qd6065Gag-Pol polyprotein3.4.23.160.477
3oxcROCProtease/0.477
3s85LK0Gag-Pol polyprotein/0.477
2idw017Protease/0.476
3tl9ROCGag-Pol polyprotein3.4.23.160.476
4rvj478Protease/0.476
1iiq0ZRGag-Pol polyprotein3.4.23.160.475
1t7kBH0Gag-Pol polyprotein3.4.23.160.475
3ekyDR7Gag-Pol polyprotein3.4.23.160.475
1hsgMK1Gag-Pol polyprotein/0.474
1z1hHBBGag-Pol polyprotein3.4.23.160.474
1zsr0ZTGag-Pol polyprotein3.4.23.160.474
2avvMK1Gag-Pol polyprotein3.4.23.160.474
3a2oKNJGag-Pol polyprotein3.4.23.160.474
3oxxDR7Gag-Pol polyprotein3.4.23.160.474
1odw0E8Gag-Pol polyprotein3.4.23.160.473
3qn8NI7Gag-Pol polyprotein3.4.23.160.473
3vfa031Gag-Pol polyprotein3.4.23.160.473
1d4kPI8Gag-Pol polyprotein3.4.23.160.472
2uxzHI1Gag-Pol polyprotein3.4.23.160.472
2wl05AHGag-Pol polyprotein/0.472
1fgc2NCGag-Pol polyprotein3.4.23.160.471
3bgcLJHGag-Pol polyprotein3.4.23.160.471
3dk1G05Gag-Pol polyprotein3.4.23.160.471
4j5j478Gag-Pol polyprotein3.4.23.160.471
1bwaXV6Gag-Pol polyprotein3.4.23.160.470
1w5xBE5Gag-Pol polyprotein3.4.23.160.470
3el9DR7Gag-Pol polyprotein3.4.23.160.470
3ok9G52Gag-Pol polyprotein3.4.23.160.470
4j55031Gag-Pol polyprotein3.4.23.160.470
4qgiROCGag-Pol polyprotein3.4.23.160.470
1a8k0Q4Gag-Pol polyprotein3.4.23.160.469
1c6zROCProtease/0.469
2a4fAAUV-1 protease/0.469
2bpw1INGag-Pol polyprotein3.4.23.160.469
2f81017Gag-Pol polyprotein3.4.23.160.469
2o4pTPVProtease/0.469
2pk5075Protease/0.469
3el1DR7Gag-Pol polyprotein3.4.23.160.469
3gi6D78Gag-Pol polyprotein/0.469
3hzc2NCProtease/0.469
2i4xKGQProtease/0.468
1hviA77Protease/0.467
1hxwRITGag-Pol polyprotein/0.467
2qnqQN3Gag-Pol polyprotein3.4.23.160.467
4hdpG52Gag-Pol polyprotein3.4.23.160.467
1sdvMK1Gag-Pol polyprotein3.4.23.160.466
2bpv1INGag-Pol polyprotein3.4.23.160.466
2pyn1UNGag-Pol polyprotein3.4.23.160.466
3oxv478Gag-Pol polyprotein3.4.23.160.466
3sa4F72Protease/0.466
4djqM86Pol polyprotein/0.466
1b6kPI5Gag-Pol polyprotein3.4.23.160.465
1d4iBEGGag-Pol polyprotein3.4.23.160.465
1wbmBLLPol protein/0.465
2p3d3TLProtease/0.465
3nu9478Gag-Pol polyprotein3.4.23.160.465
3zpuM8BGag-Pol polyprotein3.4.23.160.465
4hdbG52Gag-Pol polyprotein3.4.23.160.465
1jld0PPGag-Pol polyprotein/0.464
1k1u0Q4Gag-Pol polyprotein3.4.23.160.464
2b7zMK1Gag-Pol polyprotein/0.464
2nnpROCProtease/0.464
3em6017Gag-Pol polyprotein3.4.23.160.464
3sabF78Protease/0.464
4njuTPVProtease/0.464
2qnnQN1Gag-Pol polyprotein3.4.23.160.463
3kfn3TLGag-Pol polyprotein/0.463
3s54017Protease/0.463
1ffi2NCGag-Pol polyprotein3.4.23.160.462
1hiv1ZKGag-Pol polyprotein/0.462
1zsf0ZSGag-Pol polyprotein3.4.23.160.462
2wkz5AHGag-Pol polyprotein/0.462
3cktYDPGag-Pol polyprotein3.4.23.160.462
3k4vROCGag-Pol polyprotein3.4.23.160.462
3nduROCGag-Pol polyprotein3.4.23.160.462
3nyg2NCGag-Pol polyprotein3.4.23.160.462
3sa323XProtease/0.462
2fde385Gag-Pol polyprotein3.4.23.160.461
3qp0NI8Gag-Pol polyprotein3.4.23.160.461
3sacAF8Protease/0.461
1b6pPI7Gag-Pol polyprotein3.4.23.160.460
1sbgIM1Gag-Pol polyprotein/0.460
2qhcAB1Protease/0.460
3d1yROCGag-Pol polyprotein3.4.23.160.460
1d4sTPVGag-Pol polyprotein3.4.23.160.459
2bpy3INGag-Pol polyprotein3.4.23.160.459
3el4ROCGag-Pol polyprotein3.4.23.160.459
4djpM73Pol polyprotein/0.459
1dw60Q4Gag-Pol polyprotein3.4.23.160.458
1hihC20Gag-Pol polyprotein/0.458
1ida0POGag-Pol polyprotein3.4.23.470.458
2a1eIPFGag-Pol polyprotein3.4.23.160.458
2bb9AKCGag-Pol polyprotein3.4.23.160.458
2qd8065Gag-Pol polyprotein3.4.23.160.458
3pwrROCGag-Pol polyprotein3.4.23.160.458
1bwb146Gag-Pol polyprotein3.4.23.160.457
1hpoUNIGag-Pol polyprotein3.4.23.160.457
1xl5190Gag-Pol polyprotein3.4.23.160.457
2bpz3INGag-Pol polyprotein3.4.23.160.457
2q5kAB1Protease/0.457
3cyw017Gag-Pol polyprotein3.4.23.160.457
3cyxROCGag-Pol polyprotein3.4.23.160.457
3sa5A69Protease/0.457
3t3c017Gag-Pol polyprotein3.4.23.160.457
3ekt017Gag-Pol polyprotein3.4.23.160.456
3i2l2NCProtease/0.456
3s43478Protease/0.456
3s56ROCProtease/0.456
1b6lPI4Gag-Pol polyprotein3.4.23.160.455
1yt9OISGag-Pol polyprotein/0.455
2qi5MZ7Gag-Pol polyprotein/0.455
3d1xROCGag-Pol polyprotein3.4.23.160.455
3jw2017Gag-Pol polyprotein3.4.23.160.455
3vfb031Gag-Pol polyprotein3.4.23.160.455
1d4hBEHGag-Pol polyprotein3.4.23.160.454
2qak1UNGag-Pol polyprotein3.4.23.160.454
3i7eDJRGag-Pol polyprotein/0.454
3jvwDMPGag-Pol polyprotein3.4.23.160.454
3kfs3TLGag-Pol polyprotein/0.454
3slz3TLPutative gag-pro-pol polyprotein/0.454
4dfg0JVGag-Pol polyprotein3.4.23.160.454
1vijBAYGag-Pol polyprotein/0.453
3d1z017Gag-Pol polyprotein3.4.23.160.453
1sguMK1Gag-Pol polyprotein3.4.23.160.452
3uhl2NCGag-Pol polyprotein3.4.23.160.452
2i4uDJRProtease/0.451
2i4wKGQProtease/0.451
2qd7065Gag-Pol polyprotein3.4.23.160.451
3mxeK54Gag-Pol polyprotein3.4.23.160.451
3nuo478Gag-Pol polyprotein3.4.23.160.451
3qrsNK8Gag-Pol polyprotein3.4.23.160.451
1ebwBEIGag-Pol polyprotein3.4.23.160.450
3sa9A68Protease/0.450
1daz0Q4Gag-Pol polyprotein3.4.23.160.449
1msmJE2Gag-Pol polyprotein3.4.23.160.449
1n49RITGag-Pol polyprotein3.4.23.160.449
1npvL27Gag-Pol polyprotein3.4.23.160.449
3bva2NCGag-Pol polyprotein3.4.23.160.449
7upjINUGag-Pol polyprotein3.4.23.160.449
1bai0Q4Gag-Pro polyprotein/0.448
1ec0BEDGag-Pol polyprotein3.4.23.160.448
1t3r017Gag-Pol polyprotein3.4.23.160.448
2q3kMUWGag-Pol polyprotein/0.448
3qbfJHGGag-Pol polyprotein3.4.23.160.448
3ufnROCGag-Pol polyprotein/0.448
1b6mPI6Gag-Pol polyprotein3.4.23.160.447
1fg62NCGag-Pol polyprotein3.4.23.160.447
2ien017Gag-Pol polyprotein3.4.23.160.447
2p3a3TLPol protein/0.447
2r43G3GGag-Pol polyprotein3.4.23.160.447
3nwq2NCGag-Pol polyprotein3.4.23.160.447
4k4p3TLGag-Pol polyprotein/0.447
1bdlIM1Gag-Pol polyprotein3.4.23.160.445
1ec1BEEGag-Pol polyprotein3.4.23.160.445
1fg80Q4Gag-Pol polyprotein3.4.23.160.445
1hshMK1Gag-Pol polyprotein/0.445
1iziQ50Gag-Pol polyprotein3.4.23.160.445
1kzkJE2Gag-Pol polyprotein3.4.23.160.445
1mtrPI6Gag-Pol polyprotein3.4.23.160.445
1npa3NHGag-Pol polyprotein3.4.23.160.445
1npwLGZGag-Pol polyprotein3.4.23.160.445
1z1rHBHGag-Pol polyprotein3.4.23.160.445
3djkG55Gag-Pol polyprotein3.4.23.160.445
3o9cK20Pol polyprotein/0.445
3saa77FProtease/0.445
3vf5031Gag-Pol polyprotein3.4.23.160.445
4njt017Protease/0.445
1sdtMK1Gag-Pol polyprotein3.4.23.160.444
2aidTHKGag-Pol polyprotein3.4.23.160.444
2avm2NCGag-Pol polyprotein3.4.23.160.444
2f80017Gag-Pol polyprotein3.4.23.160.444
2f8g017Gag-Pol polyprotein3.4.23.160.444
2hb3GRLProtease/0.444
2qi7MZ9Gag-Pol polyprotein/0.444
2r5pMK1Gag-Pol polyprotein/0.444
3gi4K60Gag-Pol polyprotein/0.444
3qrmNK7Gag-Pol polyprotein3.4.23.160.444
1c6x3INProtease/0.443
1t7j478Gag-Pol polyprotein3.4.23.160.443
1w5vBE3Gag-Pol polyprotein3.4.23.160.443
2fleAIProtease/0.443
3o9bK2APol polyprotein/0.443
3t113T1Gag-Pol polyprotein3.4.23.160.443
4hegG52Gag-Pol polyprotein3.4.23.160.443
1ff02NCGag-Pol polyprotein3.4.23.160.442
1msnJE2Gag-Pol polyprotein3.4.23.160.442
1qbsDMPGag-Pol polyprotein3.4.23.160.442
2i4vDJRV-1 protease/0.442
3dcrKVSProtease/0.442
3sa6F71Protease/0.442
3ttp017Gag-Pol polyprotein3.4.23.160.442
1tcxIM1Gag-Pol polyprotein3.4.23.160.441
2cej1AHPol protein/0.441
2i0dMUTProtease/0.441
2pwcG3GGag-Pol polyprotein3.4.23.160.441
3aidARQGag-Pol polyprotein3.4.23.160.441
3ggu017Gag-Pol polyprotein3.4.23.160.441
3jvy017Gag-Pol polyprotein3.4.23.160.441
3oy4017Gag-Pol polyprotein3.4.23.160.441
3st5G89Gag-Pol polyprotein3.4.23.160.441
2qi6MZ8Gag-Pol polyprotein/0.440
3ekx1UNGag-Pol polyprotein3.4.23.160.440
3em3478Gag-Pol polyprotein3.4.23.160.440
3qpjN4IGag-Pol polyprotein3.4.23.160.440
9hvp0E9Gag-Pol polyprotein/0.440