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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
3nwq2NCGag-Pol polyprotein3.4.23.16

Complex with similar cavities

PDB ID HET Uniprot Name EC Number Cavity
Similarity
Align
3nwq2NCGag-Pol polyprotein3.4.23.161.000
1k6tXN1Gag-Pol polyprotein3.4.23.160.640
3nwxKVSGag-Pol polyprotein3.4.23.160.631
1k6cMK1Gag-Pol polyprotein3.4.23.160.622
1k6vXN2Gag-Pol polyprotein3.4.23.160.591
3t113T1Gag-Pol polyprotein3.4.23.160.584
3nxe2NCProtease/0.579
3zpsEQMGag-Pol polyprotein3.4.23.160.563
1hvjA78Gag-Pol polyprotein/0.562
4j55031Gag-Pol polyprotein3.4.23.160.560
1hvlA76Gag-Pol polyprotein/0.559
1fej2NCGag-Pol polyprotein3.4.23.160.556
3nyg2NCGag-Pol polyprotein3.4.23.160.556
2nmyROCProtease/0.555
1ff02NCGag-Pol polyprotein3.4.23.160.552
3bheBZNGag-Pol polyprotein3.4.23.160.549
1ivp1ZKGag-Pol polyprotein/0.547
3d1yROCGag-Pol polyprotein3.4.23.160.547
3hzc2NCProtease/0.547
3tl9ROCGag-Pol polyprotein3.4.23.160.547
1hvkA79Gag-Pol polyprotein/0.542
2aquDR7Gag-Pol polyprotein3.4.23.160.540
1b6pPI7Gag-Pol polyprotein3.4.23.160.538
3bxsDRSGag-Pol polyprotein3.4.23.160.538
1ec3MS3Gag-Pol polyprotein3.4.23.160.537
2nnkROCProtease/0.537
2xyeCXGGag-Pol polyprotein/0.537
2xyfG40Gag-Pol polyprotein/0.537
3i2l2NCProtease/0.537
3zptM8YGag-Pol polyprotein3.4.23.160.536
4hdfG52Gag-Pol polyprotein3.4.23.160.536
4njvRITProtease/0.536
4djoMK5Pol polyprotein/0.535
1fgc2NCGag-Pol polyprotein3.4.23.160.533
1difA85Gag-Pol polyprotein/0.532
2pk5075Protease/0.532
2fxeDR7Gag-Pol polyprotein3.4.23.160.531
2a4fAAUV-1 protease/0.528
3oxxDR7Gag-Pol polyprotein3.4.23.160.528
1hxbROCGag-Pol polyprotein3.4.23.160.527
2hc0AB2Protease/0.526
3cktYDPGag-Pol polyprotein3.4.23.160.526
1d4lPI9Gag-Pol polyprotein3.4.23.160.525
2bpy3INGag-Pol polyprotein3.4.23.160.525
2fdd385Pol protein/0.525
3nduROCGag-Pol polyprotein3.4.23.160.525
3pwrROCGag-Pol polyprotein3.4.23.160.525
1a8g2Z4Gag-Pol polyprotein3.4.23.160.524
1ec2BEJGag-Pol polyprotein3.4.23.160.524
2qnqQN3Gag-Pol polyprotein3.4.23.160.524
3kdcJZPGag-Pol polyprotein3.4.23.160.524
1fg80Q4Gag-Pol polyprotein3.4.23.160.523
1hvsA77Gag-Pol polyprotein/0.523
3ggaGGWGag-Pol polyprotein/0.523
3oxcROCProtease/0.523
4ye3G04Gag-Pol polyprotein3.4.23.160.523
3el4ROCGag-Pol polyprotein3.4.23.160.522
2pk6O33V-1 protease/0.521
2qhcAB1Protease/0.521
3d1xROCGag-Pol polyprotein3.4.23.160.521
3ekqROCGag-Pol polyprotein3.4.23.160.521
3kf03TLGag-Pol polyprotein/0.521
2qd8065Gag-Pol polyprotein3.4.23.160.520
3dcrKVSProtease/0.520
3sa755AProtease/0.520
3ttp017Gag-Pol polyprotein3.4.23.160.520
1d4yTPVGag-Pol polyprotein3.4.23.160.519
1hxwRITGag-Pol polyprotein/0.519
2cem2AHPol protein/0.519
2ieo017Protease/0.519
3kfr3TLGag-Pol polyprotein/0.519
3s56ROCProtease/0.519
2aoe0Q4Gag-Pol polyprotein3.4.23.160.518
2qd6065Gag-Pol polyprotein3.4.23.160.518
2qi3MZ5Gag-Pol polyprotein/0.518
3a2oKNJGag-Pol polyprotein3.4.23.160.518
3k4vROCGag-Pol polyprotein3.4.23.160.518
3ndtROCGag-Pol polyprotein3.4.23.160.518
3s85LK0Gag-Pol polyprotein/0.518
2avm2NCGag-Pol polyprotein3.4.23.160.517
3cyxROCGag-Pol polyprotein3.4.23.160.517
3ggxGGXGag-Pol polyprotein/0.517
3ndwRITGag-Pol polyprotein3.4.23.160.517
1k1u0Q4Gag-Pol polyprotein3.4.23.160.515
2qhyMZ1Gag-Pol polyprotein/0.515
3ekt017Gag-Pol polyprotein3.4.23.160.515
3zpuM8BGag-Pol polyprotein3.4.23.160.515
4hdbG52Gag-Pol polyprotein3.4.23.160.515
2bpz3INGag-Pol polyprotein3.4.23.160.514
2idw017Protease/0.514
3ekwDR7Gag-Pol polyprotein3.4.23.160.514
3jw2017Gag-Pol polyprotein3.4.23.160.514
3ok9G52Gag-Pol polyprotein3.4.23.160.514
3qn8NI7Gag-Pol polyprotein3.4.23.160.514
3sa323XProtease/0.514
4djqM86Pol polyprotein/0.514
2bqvA1AProtease/0.513
2p3b3TLV-1 PROTEASE protein/0.513
2p3b3TLV-1 protease/0.513
3ekp478Gag-Pol polyprotein3.4.23.160.513
3sa5A69Protease/0.513
4a6bQG8Gag-Pol polyprotein3.4.23.160.513
1k2b0Q4Gag-Pol polyprotein3.4.23.160.512
2uy0HV1Gag-Pol polyprotein3.4.23.160.512
3st5G89Gag-Pol polyprotein3.4.23.160.512
3vf5031Gag-Pol polyprotein3.4.23.160.512
1bdrIM1Gag-Pol polyprotein3.4.23.160.511
1fg62NCGag-Pol polyprotein3.4.23.160.511
1odw0E8Gag-Pol polyprotein3.4.23.160.511
2bpv1INGag-Pol polyprotein3.4.23.160.511
3dckKVIProtease/0.511
3kfn3TLGag-Pol polyprotein/0.511
3nu9478Gag-Pol polyprotein3.4.23.160.511
4j5j478Gag-Pol polyprotein3.4.23.160.511
1ebwBEIGag-Pol polyprotein3.4.23.160.510
1iiq0ZRGag-Pol polyprotein3.4.23.160.510
3ndxRITGag-Pol polyprotein3.4.23.160.510
4kb9G79Protease/0.510
4njt017Protease/0.510
1hsgMK1Gag-Pol polyprotein/0.509
3el01UNGag-Pol polyprotein3.4.23.160.509
3el51UNGag-Pol polyprotein/0.509
3gi4K60Gag-Pol polyprotein/0.509
3kfs3TLGag-Pol polyprotein/0.509
1c6x3INProtease/0.508
1c6zROCProtease/0.508
1daz0Q4Gag-Pol polyprotein3.4.23.160.508
1ffi2NCGag-Pol polyprotein3.4.23.160.508
1xl2189Gag-Pol polyprotein3.4.23.160.508
2cen4AHProtease/0.508
2f8g017Gag-Pol polyprotein3.4.23.160.508
2fde385Gag-Pol polyprotein3.4.23.160.508
3aidARQGag-Pol polyprotein3.4.23.160.508
3jvy017Gag-Pol polyprotein3.4.23.160.508
3t3c017Gag-Pol polyprotein3.4.23.160.508
1hosPHPGag-Pol polyprotein/0.507
1hpxKNIGag-Pol polyprotein/0.507
2wkz5AHGag-Pol polyprotein/0.507
3em4DR7Gag-Pol polyprotein3.4.23.160.507
3qp0NI8Gag-Pol polyprotein3.4.23.160.507
1hviA77Protease/0.506
1jld0PPGag-Pol polyprotein/0.506
2fxdDR7Pol polyprotein/0.506
3dk1G05Gag-Pol polyprotein3.4.23.160.506
3em6017Gag-Pol polyprotein3.4.23.160.506
3gi6D78Gag-Pol polyprotein/0.506
3sa9A68Protease/0.506
3vfa031Gag-Pol polyprotein3.4.23.160.506
4hdpG52Gag-Pol polyprotein3.4.23.160.506
1b6mPI6Gag-Pol polyprotein3.4.23.160.505
1hshMK1Gag-Pol polyprotein/0.505
1iziQ50Gag-Pol polyprotein3.4.23.160.505
1rl8RITGag-Pol polyprotein3.4.23.160.505
1vijBAYGag-Pol polyprotein/0.505
1vikBAYGag-Pol polyprotein/0.505
1yt9OISGag-Pol polyprotein/0.505
2f81017Gag-Pol polyprotein3.4.23.160.505
2i4xKGQProtease/0.505
2q54MU1Protease/0.505
2qnnQN1Gag-Pol polyprotein3.4.23.160.505
3i7eDJRGag-Pol polyprotein/0.505
4qgiROCGag-Pol polyprotein3.4.23.160.505
1dw60Q4Gag-Pol polyprotein3.4.23.160.504
2f3kRO1Protease/0.504
2r43G3GGag-Pol polyprotein3.4.23.160.504
3qrmNK7Gag-Pol polyprotein3.4.23.160.504
1zsr0ZTGag-Pol polyprotein3.4.23.160.503
3ekyDR7Gag-Pol polyprotein3.4.23.160.503
3linE13Protease/0.503
4rvj478Protease/0.503
1z1hHBBGag-Pol polyprotein3.4.23.160.502
3qbfJHGGag-Pol polyprotein3.4.23.160.502
2b60RITPol polyprotein/0.501
2b7zMK1Gag-Pol polyprotein/0.501
2bpw1INGag-Pol polyprotein3.4.23.160.501
2f80017Gag-Pol polyprotein3.4.23.160.501
3el9DR7Gag-Pol polyprotein3.4.23.160.501
3sa4F72Protease/0.501
3sabF78Protease/0.501
2a1eIPFGag-Pol polyprotein3.4.23.160.500
2hb3GRLProtease/0.500
2wl05AHGag-Pol polyprotein/0.500
4djr0KJPol polyprotein/0.500
1ec1BEEGag-Pol polyprotein3.4.23.160.499
1t7i017Gag-Pol polyprotein3.4.23.160.499
3el1DR7Gag-Pol polyprotein3.4.23.160.499
3vfb031Gag-Pol polyprotein3.4.23.160.499
4dqe017Gag-Pol polyprotein/0.499
7upjINUGag-Pol polyprotein3.4.23.160.499
1sdtMK1Gag-Pol polyprotein3.4.23.160.498
1w5yBE6Gag-Pol polyprotein3.4.23.160.498
2bb9AKCGag-Pol polyprotein3.4.23.160.498
3ekv478Gag-Pol polyprotein3.4.23.160.498
3saa77FProtease/0.498
4hegG52Gag-Pol polyprotein3.4.23.160.498
4njsG08Protease/0.498
1a9mU0EGag-Pol polyprotein/0.497
1hiiC20Gag-Pol polyprotein/0.497
1wbmBLLPol protein/0.497
2qd7065Gag-Pol polyprotein3.4.23.160.497
1d4sTPVGag-Pol polyprotein3.4.23.160.496
1ohr1UNV-1 PROTEASE protein/0.496
2pqzG0GGag-Pol polyprotein3.4.23.160.496
2qhzMZ2Gag-Pol polyprotein/0.496
4a4qUX9Pol protein/0.496
1b6kPI5Gag-Pol polyprotein3.4.23.160.495
1w5xBE5Gag-Pol polyprotein3.4.23.160.495
2qnpQN2Gag-Pol polyprotein3.4.23.160.495
3jvwDMPGag-Pol polyprotein3.4.23.160.495
3oxw017Gag-Pol polyprotein3.4.23.160.495
1ida0POGag-Pol polyprotein3.4.23.470.494
1sduMK1Gag-Pol polyprotein3.4.23.160.494
1xl5190Gag-Pol polyprotein3.4.23.160.494
2nnpROCProtease/0.494
2p3d3TLProtease/0.494
3bva2NCGag-Pol polyprotein3.4.23.160.494
1sdvMK1Gag-Pol polyprotein3.4.23.160.493
1tcxIM1Gag-Pol polyprotein3.4.23.160.493
2i4wKGQProtease/0.493
3s54017Protease/0.493
4k4p3TLGag-Pol polyprotein/0.493
1zsf0ZSGag-Pol polyprotein3.4.23.160.492
2ien017Gag-Pol polyprotein3.4.23.160.492
2upjU02Gag-Pol polyprotein3.4.23.160.492
3o9cK20Pol polyprotein/0.492
1d4kPI8Gag-Pol polyprotein3.4.23.160.491
1ec0BEDGag-Pol polyprotein3.4.23.160.491
1hiv1ZKGag-Pol polyprotein/0.491
3gi5K62Gag-Pol polyprotein/0.491
3mxeK54Gag-Pol polyprotein3.4.23.160.491
3nu4478Gag-Pol polyprotein3.4.23.160.491
1bai0Q4Gag-Pro polyprotein/0.490
1c70L75Protease/0.490
1qbu846Gag-Pol polyprotein3.4.23.160.490
2uxzHI1Gag-Pol polyprotein3.4.23.160.490
3kddJZQGag-Pol polyprotein3.4.23.160.490
3tog079Gag-Pol polyprotein2.7.7.490.490
4a6cQG9Gag-Pol polyprotein3.4.23.160.490
1npa3NHGag-Pol polyprotein3.4.23.160.489
1npwLGZGag-Pol polyprotein3.4.23.160.489
2hs2017Protease/0.489
3bgbLJGGag-Pol polyprotein3.4.23.160.489
2pyn1UNGag-Pol polyprotein3.4.23.160.488
2q5kAB1Protease/0.488
2r5pMK1Gag-Pol polyprotein/0.488
2rkfAB1Pol protein/0.488
3djkG55Gag-Pol polyprotein3.4.23.160.488
3qrsNK8Gag-Pol polyprotein3.4.23.160.488
1t7kBH0Gag-Pol polyprotein3.4.23.160.487
2q641UNGag-Pol polyprotein3.4.23.160.487
2qi5MZ7Gag-Pol polyprotein/0.487
3sa6F71Protease/0.487
1hpoUNIGag-Pol polyprotein3.4.23.160.486
2cej1AHPol protein/0.486
2qci065Gag-Pol polyprotein3.4.23.160.486
2qi7MZ9Gag-Pol polyprotein/0.486
3o9iA61Gag-Pol polyprotein/0.486
3uhl2NCGag-Pol polyprotein3.4.23.160.486
3vf7031Gag-Pol polyprotein3.4.23.160.486
1b6lPI4Gag-Pol polyprotein3.4.23.160.485
1izhQ50Protease/0.485
1mtrPI6Gag-Pol polyprotein3.4.23.160.485
2r3tG4GGag-Pol polyprotein3.4.23.160.485
3liqE14Protease/0.485
3qaaG04Gag-Pol polyprotein3.4.23.160.485
1fff0Q4Gag-Pol polyprotein3.4.23.160.484
1g35AHFGag-Pol polyprotein3.4.23.160.484
1sbgIM1Gag-Pol polyprotein/0.484
1t3r017Gag-Pol polyprotein3.4.23.160.484
1w5vBE3Gag-Pol polyprotein3.4.23.160.484
2i4vDJRV-1 protease/0.484
2pym1UNGag-Pol polyprotein3.4.23.160.484
2z54AB1Gag-Pol polyprotein3.4.23.160.484
1sh9RITGag-Pol polyprotein3.4.23.160.483
1wbk568Pol protein/0.483
2aidTHKGag-Pol polyprotein3.4.23.160.483
3qroNK9Gag-Pol polyprotein3.4.23.160.483
3sacAF8Protease/0.483
4hla017Gag-Pol polyprotein3.4.23.160.483
2avvMK1Gag-Pol polyprotein3.4.23.160.482
2r3wG3GGag-Pol polyprotein3.4.23.160.482
1meuDMPGag-Pol polyprotein3.4.23.160.481
1muiAB1Protease/0.481
4dqc017Gag-Pol polyprotein/0.481
1idb0DOGag-Pol polyprotein/0.480
2pwcG3GGag-Pol polyprotein3.4.23.160.480
2qi0MZ3Gag-Pol polyprotein/0.480
2qi6MZ8Gag-Pol polyprotein/0.480
3fx5KNIGag-Pol polyprotein3.4.23.160.480
4dfg0JVGag-Pol polyprotein3.4.23.160.480
4q1y017Gag-Pol polyprotein3.4.23.160.480
2qak1UNGag-Pol polyprotein3.4.23.160.479
3em3478Gag-Pol polyprotein3.4.23.160.479
3oxv478Gag-Pol polyprotein3.4.23.160.479
3s43478Protease/0.479
1qbrXV6Gag-Pol polyprotein3.4.23.160.478
2avsMK1Gag-Pol polyprotein3.4.23.160.478
3cyw017Gag-Pol polyprotein3.4.23.160.478
3lzu017Gag-Pol polyprotein3.4.23.160.478
3ufnROCGag-Pol polyprotein/0.478
1a940Q4Gag-Pol polyprotein3.4.23.160.477
1bwaXV6Gag-Pol polyprotein3.4.23.160.477
1n49RITGag-Pol polyprotein3.4.23.160.477
1sguMK1Gag-Pol polyprotein3.4.23.160.477
2p3a3TLPol protein/0.477
3nls016Gag-Pol polyprotein3.4.23.160.477
3sa8K83Protease/0.477
4dqb017Gag-Pol polyprotein/0.477
1c6yMK1Protease/0.476
1ebzBECGag-Pol polyprotein3.4.23.160.476
2r38G4GGag-Pol polyprotein3.4.23.160.476
3d20017Gag-Pol polyprotein3.4.23.160.476
4djpM73Pol polyprotein/0.476
9hvp0E9Gag-Pol polyprotein/0.476
1bdlIM1Gag-Pol polyprotein3.4.23.160.475
1bv7XV6Gag-Pol polyprotein3.4.23.160.475
1ebyBEBGag-Pol polyprotein3.4.23.160.475
1m0b0ZQGag-Pol polyprotein3.4.23.160.475
3mws017Pol protein/0.475
4dqh017Gag-Pol polyprotein/0.475
3bxrDRRGag-Pol polyprotein3.4.23.160.474
3nuo478Gag-Pol polyprotein3.4.23.160.474
3toh079Gag-Pol polyprotein2.7.7.490.474
1ajvNMBGag-Pol polyprotein3.4.23.160.473
1hihC20Gag-Pol polyprotein/0.473
3i6oGR6Gag-Pol polyprotein3.4.23.160.473
3o9gF53Gag-Pol polyprotein/0.473
3qihFG7Gag-Pol polyprotein3.4.23.160.473
4njuTPVProtease/0.473
1qbsDMPGag-Pol polyprotein3.4.23.160.472
1z1rHBHGag-Pol polyprotein3.4.23.160.472
2hs1017Protease/0.472
2psuMUUProtease/0.472
3o9eA60Pol polyprotein/0.472
4i8zG08Gag-Pol polyprotein3.4.23.160.472
2q631UNGag-Pol polyprotein3.4.23.160.471
2r5q1UNGag-Pol polyprotein/0.471
4gb20LQGag-Pol polyprotein2.7.7.490.471
2i4uDJRProtease/0.470
3nu5478Gag-Pol polyprotein3.4.23.160.470
6upjNIUGag-Pol polyprotein/0.470
1ajxAH1Gag-Pol polyprotein3.4.23.160.469
1ivq0PXGag-Pol polyprotein/0.469
1qbt146Gag-Pol polyprotein3.4.23.160.469
1tcwIM1Gag-Pol polyprotein/0.469
1odyLP1Gag-Pol polyprotein3.4.23.160.468
1sivPSIGag-Pol polyprotein/0.468
2p3c3TLProtease/0.468
3bvb017Gag-Pol polyprotein3.4.23.160.468
3livE16Protease/0.468
3lzv017Gag-Pol polyprotein3.4.23.160.468
1mesDMPGag-Pol polyprotein3.4.23.160.467
2i4dQFIProtease/0.467
3ggu017Gag-Pol polyprotein3.4.23.160.467
1kzkJE2Gag-Pol polyprotein3.4.23.160.466
2q3kMUWGag-Pol polyprotein/0.466
3nu6478Gag-Pol polyprotein3.4.23.160.466
4dqf017Gag-Pol polyprotein/0.466
2o4pTPVProtease/0.465
3d1z017Gag-Pol polyprotein3.4.23.160.465
3o9fK2DGag-Pol polyprotein/0.465
3qihNI7Gag-Pol polyprotein3.4.23.160.465
2fleAIProtease/0.464
2qi1MZ4Gag-Pol polyprotein/0.464
1bdqIM1Gag-Pol polyprotein3.4.23.160.463
1g2kNM1Gag-Pol polyprotein3.4.23.160.463
2bpxMK1Gag-Pol polyprotein3.4.23.160.463
3ec0GRLGag-Pol polyprotein3.4.23.470.463
3nuj478Gag-Pol polyprotein3.4.23.160.463
3o9bK2APol polyprotein/0.463
3o9dK19Pol polyprotein/0.463
3pwm017Gag-Pol polyprotein3.4.23.160.463
1d4iBEGGag-Pol polyprotein3.4.23.160.462
1hwr216Gag-Pol polyprotein3.4.23.160.462
2qi4MZ6Gag-Pol polyprotein/0.462
3bgcLJHGag-Pol polyprotein3.4.23.160.462
1hpv478Gag-Pol polyprotein/0.461
3lzs017Gag-Pol polyprotein3.4.23.160.461
2psvMUVProtease/0.460
3ekx1UNGag-Pol polyprotein3.4.23.160.460
3o9aK14Pol polyprotein/0.460
1a8k0Q4Gag-Pol polyprotein3.4.23.160.459
3tof076Gag-Pol polyprotein2.7.7.490.459
3mxdK53Gag-Pol polyprotein3.4.23.160.458
4j54G52Gag-Pol polyprotein3.4.23.160.458
1d4hBEHGag-Pol polyprotein3.4.23.160.457
2z4o065Gag-Pol polyprotein3.4.23.160.457
1hvrXK2Gag-Pol polyprotein/0.456
3o9hK2EGag-Pol polyprotein/0.456
3ogqAB1Pol polyprotein/0.456
3ucb017Gag-Pol polyprotein/0.456
1msmJE2Gag-Pol polyprotein3.4.23.160.455
1hvhQ82Gag-Pol polyprotein3.4.23.160.454
3upjU03Gag-Pol polyprotein/0.454
3wsjMK1Protease/0.453
1proA88Gag-Pol polyprotein/0.452
1bwb146Gag-Pol polyprotein3.4.23.160.451
3oy4017Gag-Pol polyprotein3.4.23.160.451
1d4jMSCGag-Pol polyprotein3.4.23.160.449
1npvL27Gag-Pol polyprotein3.4.23.160.449
2bbbHH1Gag-Pol polyprotein3.4.23.160.447
1hbvGANGag-Pol polyprotein/0.446
3o99K13Pol polyprotein/0.446
3qpjN4IGag-Pol polyprotein3.4.23.160.446
1bv9XV6Gag-Pol polyprotein3.4.23.160.445
3lixE17Protease/0.445
3litE15Protease/0.444
3so9017Pol protein/0.444
1merDMQGag-Pol polyprotein3.4.23.160.442
5upjUINGag-Pol polyprotein/0.442
2q55MU0Protease/0.440