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sc-PDB

An Annotated Database of Druggable Binding Sites from the Protein DataBank

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Distribution of Interaction pattern similarity measured by Grim
You can zoom onto the graph by using the mouse to make a selection

Binding Modes are compared using Grim.
For more information, please see the following publication: Desaphy J. et al. Encoding Protein-Ligand Interaction Patterns in Fingerprints and Graphs J. Chem. Inf. Model., 2013, 53 (3), pp 623-637
Binding modes are considered as similar when the similarity value is greater than 0.65


Reference Protein Data Bank Entry :
PDB ID HET Uniprot Name EC Number
3ok9 G52 Gag-Pol polyprotein 3.4.23.16

Complex with similar interaction patterns:

PDB ID HET Uniprot Name EC Number Binding Mode
Similarity
Align
3ok9 G52Gag-Pol polyprotein 3.4.23.16 1.374
2qci 065Gag-Pol polyprotein 3.4.23.16 1.258
4heg G52Gag-Pol polyprotein 3.4.23.16 1.248
2z4o 065Gag-Pol polyprotein 3.4.23.16 1.244
4hdb G52Gag-Pol polyprotein 3.4.23.16 1.232
3pwm 017Gag-Pol polyprotein 3.4.23.16 1.221
3qaa G04Gag-Pol polyprotein 3.4.23.16 1.221
3st5 G89Gag-Pol polyprotein 3.4.23.16 1.202
2qd6 065Gag-Pol polyprotein 3.4.23.16 1.190
3dk1 G05Gag-Pol polyprotein 3.4.23.16 1.190
3ecg 065Gag-Pol polyprotein 3.4.23.47 1.175
4kb9 G79Protease / 1.174
2qd8 065Gag-Pol polyprotein 3.4.23.16 1.169
3d20 017Gag-Pol polyprotein 3.4.23.16 1.163
4dfg 0JVGag-Pol polyprotein 3.4.23.16 1.163
2qd7 065Gag-Pol polyprotein 3.4.23.16 1.155
3vf5 031Gag-Pol polyprotein 3.4.23.16 1.145
2f80 017Gag-Pol polyprotein 3.4.23.16 1.132
3o9f K2DGag-Pol polyprotein / 1.130
3o9a K14Pol polyprotein / 1.128
4dqc 017Gag-Pol polyprotein / 1.117
2hb3 GRLProtease / 1.115
3o9h K2EGag-Pol polyprotein / 1.115
2ieo 017Protease / 1.110
3o9b K2APol polyprotein / 1.108
2f81 017Gag-Pol polyprotein 3.4.23.16 1.105
4dqe 017Gag-Pol polyprotein / 1.102
4hdf G52Gag-Pol polyprotein 3.4.23.16 1.099
3lzs 017Gag-Pol polyprotein 3.4.23.16 1.097
3oy4 017Gag-Pol polyprotein 3.4.23.16 1.097
4hdp G52Gag-Pol polyprotein 3.4.23.16 1.097
4njs G08Protease / 1.097
3d1z 017Gag-Pol polyprotein 3.4.23.16 1.094
3djk G55Gag-Pol polyprotein 3.4.23.16 1.094
4dqb 017Gag-Pol polyprotein / 1.089
3vfa 031Gag-Pol polyprotein 3.4.23.16 1.083
3vf7 031Gag-Pol polyprotein 3.4.23.16 1.077
3cyw 017Gag-Pol polyprotein 3.4.23.16 1.072
3r4b 74TGag-Pol polyprotein / 1.071
1t3r 017Gag-Pol polyprotein 3.4.23.16 1.065
4djo MK5Pol polyprotein / 1.065
2i4d QFIProtease / 1.064
2ien 017Gag-Pol polyprotein 3.4.23.16 1.062
3o9c K20Pol polyprotein / 1.056
4dqf 017Gag-Pol polyprotein / 1.056
2i4u DJRProtease / 1.053
4q1w 017Gag-Pol polyprotein 3.4.23.16 1.050
3jvy 017Gag-Pol polyprotein 3.4.23.16 1.049
2idw 017Protease / 1.047
4ye3 G04Gag-Pol polyprotein 3.4.23.16 1.038
3bvb 017Gag-Pol polyprotein 3.4.23.16 1.036
3mxd K53Gag-Pol polyprotein 3.4.23.16 1.035
4djq M86Pol polyprotein / 1.035
4j54 G52Gag-Pol polyprotein 3.4.23.16 1.034
3o9d K19Pol polyprotein / 1.032
3o9i A61Gag-Pol polyprotein / 1.030
3o9e A60Pol polyprotein / 1.029
2fdd 385Pol protein / 1.023
4i8z G08Gag-Pol polyprotein 3.4.23.16 1.023
2i4x KGQProtease / 1.022
2i0a MUIProtease / 1.017
3sab F78Protease / 1.016
4q1y 017Gag-Pol polyprotein 3.4.23.16 1.016
3s54 017Protease / 1.015
3o9g F53Gag-Pol polyprotein / 1.013
3ec0 GRLGag-Pol polyprotein 3.4.23.47 1.012
3mws 017Pol protein / 1.012
3lzu 017Gag-Pol polyprotein 3.4.23.16 1.003
2hs2 017Protease / 1.002
3saa 77FProtease / 0.999
3ucb 017Gag-Pol polyprotein / 0.997
3t3c 017Gag-Pol polyprotein 3.4.23.16 0.995
3mxe K54Gag-Pol polyprotein 3.4.23.16 0.993
3sa8 K83Protease / 0.992
3ekv 478Gag-Pol polyprotein 3.4.23.16 0.991
2i0d MUTProtease / 0.985
3gi6 D78Gag-Pol polyprotein / 0.985
3oxw 017Gag-Pol polyprotein 3.4.23.16 0.978
2qi4 MZ6Gag-Pol polyprotein / 0.977
3vfb 031Gag-Pol polyprotein 3.4.23.16 0.977
3gi4 K60Gag-Pol polyprotein / 0.976
2hs1 017Protease / 0.975
3i6o GR6Gag-Pol polyprotein 3.4.23.16 0.969
2qi7 MZ9Gag-Pol polyprotein / 0.965
3lzv 017Gag-Pol polyprotein 3.4.23.16 0.965
3nu6 478Gag-Pol polyprotein 3.4.23.16 0.962
3ggu 017Gag-Pol polyprotein 3.4.23.16 0.958
4njt 017Protease / 0.955
3em3 478Gag-Pol polyprotein 3.4.23.16 0.951
4djp M73Pol polyprotein / 0.950
2f8g 017Gag-Pol polyprotein 3.4.23.16 0.949
3jw2 017Gag-Pol polyprotein 3.4.23.16 0.948
3gi5 K62Gag-Pol polyprotein / 0.946
3ttp 017Gag-Pol polyprotein 3.4.23.16 0.945
3em6 017Gag-Pol polyprotein 3.4.23.16 0.942
4j55 031Gag-Pol polyprotein 3.4.23.16 0.936
2qi0 MZ3Gag-Pol polyprotein / 0.935
2qi6 MZ8Gag-Pol polyprotein / 0.934
3nu5 478Gag-Pol polyprotein 3.4.23.16 0.933
4dqh 017Gag-Pol polyprotein / 0.933
2qhy MZ1Gag-Pol polyprotein / 0.928
4q1x 017Gag-Pol polyprotein 3.4.23.16 0.923
3o99 K13Pol polyprotein / 0.919
3ekt 017Gag-Pol polyprotein 3.4.23.16 0.917
2i4v DJRV-1 protease / 0.914
3nu9 478Gag-Pol polyprotein 3.4.23.16 0.913
3sa9 A68Protease / 0.912
2qi5 MZ7Gag-Pol polyprotein / 0.910
1t7i 017Gag-Pol polyprotein 3.4.23.16 0.908
3sa4 F72Protease / 0.907
1z1r HBHGag-Pol polyprotein 3.4.23.16 0.905
2qi3 MZ5Gag-Pol polyprotein / 0.903
3nuj 478Gag-Pol polyprotein 3.4.23.16 0.900
3i7e DJRGag-Pol polyprotein / 0.886
3sa5 A69Protease / 0.885
3sa3 23XProtease / 0.882
3sa7 55AProtease / 0.881
3nu4 478Gag-Pol polyprotein 3.4.23.16 0.871
2qhz MZ2Gag-Pol polyprotein / 0.869
2psu MUUProtease / 0.868
4djr 0KJPol polyprotein / 0.866
3s43 478Protease / 0.865
3oxv 478Gag-Pol polyprotein 3.4.23.16 0.863
3oxx DR7Gag-Pol polyprotein 3.4.23.16 0.858
3nu3 478Gag-Pol polyprotein 3.4.23.16 0.856
3sac AF8Protease / 0.855
2fde 385Gag-Pol polyprotein 3.4.23.16 0.850
1xl5 190Gag-Pol polyprotein 3.4.23.16 0.849
3nuo 478Gag-Pol polyprotein 3.4.23.16 0.846
4hla 017Gag-Pol polyprotein 3.4.23.16 0.846
4rvj 478Protease / 0.843
1z1h HBBGag-Pol polyprotein 3.4.23.16 0.841
3sm2 478Putative gag-pro-pol polyprotein / 0.827
2i4w KGQProtease / 0.824
1hpv 478Gag-Pol polyprotein / 0.819
1d4l PI9Gag-Pol polyprotein 3.4.23.16 0.817
3em4 DR7Gag-Pol polyprotein 3.4.23.16 0.806
3sa6 F71Protease / 0.801
3eky DR7Gag-Pol polyprotein 3.4.23.16 0.795
2pk5 075Protease / 0.791
1mrw K57Gag-Pol polyprotein 3.4.23.16 0.790
3a2o KNJGag-Pol polyprotein 3.4.23.16 0.786
4j5j 478Gag-Pol polyprotein 3.4.23.16 0.786
2wkz 5AHGag-Pol polyprotein / 0.781
2cem 2AHPol protein / 0.774
3el9 DR7Gag-Pol polyprotein 3.4.23.16 0.774
2pk6 O33V-1 protease / 0.772
2psv MUVProtease / 0.769
3nyg 2NCGag-Pol polyprotein 3.4.23.16 0.766
1b6l PI4Gag-Pol polyprotein 3.4.23.16 0.765
3ekp 478Gag-Pol polyprotein 3.4.23.16 0.764
1b6m PI6Gag-Pol polyprotein 3.4.23.16 0.763
2aoe 0Q4Gag-Pol polyprotein 3.4.23.16 0.756
1k2c 0Q4Gag-Pol polyprotein 3.4.23.16 0.750
2aqu DR7Gag-Pol polyprotein 3.4.23.16 0.750
3el4 ROCGag-Pol polyprotein 3.4.23.16 0.749
2hc0 AB2Protease / 0.747
3kdb 006Gag-Pol polyprotein 3.4.23.16 0.745
2q54 MU1Protease / 0.744
1ida 0POGag-Pol polyprotein 3.4.23.47 0.743
2nmy ROCProtease / 0.743
3i2l 2NCProtease / 0.743
1fgc 2NCGag-Pol polyprotein 3.4.23.16 0.742
1bdr IM1Gag-Pol polyprotein 3.4.23.16 0.741
1mtr PI6Gag-Pol polyprotein 3.4.23.16 0.739
1ajv NMBGag-Pol polyprotein 3.4.23.16 0.738
1mrx K57Gag-Pol polyprotein 3.4.23.16 0.738
2wl0 5AHGag-Pol polyprotein / 0.736
3kfn 3TLGag-Pol polyprotein / 0.734
1d4i BEGGag-Pol polyprotein 3.4.23.16 0.733
1fff 0Q4Gag-Pol polyprotein 3.4.23.16 0.733
1m0b 0ZQGag-Pol polyprotein 3.4.23.16 0.733
3dck KVIProtease / 0.728
3hzc 2NCProtease / 0.728
1yt9 OISGag-Pol polyprotein / 0.727
2fxe DR7Gag-Pol polyprotein 3.4.23.16 0.727
2pym 1UNGag-Pol polyprotein 3.4.23.16 0.727
3d1y ROCGag-Pol polyprotein 3.4.23.16 0.727
3kfr 3TLGag-Pol polyprotein / 0.727
1fej 2NCGag-Pol polyprotein 3.4.23.16 0.726
2avm 2NCGag-Pol polyprotein 3.4.23.16 0.726
2p3c 3TLProtease / 0.722
3nwq 2NCGag-Pol polyprotein 3.4.23.16 0.722
1ffi 2NCGag-Pol polyprotein 3.4.23.16 0.721
2f3k RO1Protease / 0.720
1zsr 0ZTGag-Pol polyprotein 3.4.23.16 0.719
2nnp ROCProtease / 0.718
2q63 1UNGag-Pol polyprotein 3.4.23.16 0.718
1fg8 0Q4Gag-Pol polyprotein 3.4.23.16 0.716
2p3a 3TLPol protein / 0.716
1npa 3NHGag-Pol polyprotein 3.4.23.16 0.715
1npw LGZGag-Pol polyprotein 3.4.23.16 0.715
2bb9 AKCGag-Pol polyprotein 3.4.23.16 0.715
2cen 4AHProtease / 0.715
3tl9 ROCGag-Pol polyprotein 3.4.23.16 0.714
2fle AIProtease / 0.712
3bva 2NCGag-Pol polyprotein 3.4.23.16 0.712
3k4v ROCGag-Pol polyprotein 3.4.23.16 0.712
3pwr ROCGag-Pol polyprotein 3.4.23.16 0.712
1t7j 478Gag-Pol polyprotein 3.4.23.16 0.711
2uxz HI1Gag-Pol polyprotein 3.4.23.16 0.711
3ekw DR7Gag-Pol polyprotein 3.4.23.16 0.711
3nxe 2NCProtease / 0.710
3s56 ROCProtease / 0.710
3el0 1UNGag-Pol polyprotein 3.4.23.16 0.709
1k6t XN1Gag-Pol polyprotein 3.4.23.16 0.707
1siv PSIGag-Pol polyprotein / 0.703
2o4p TPVProtease / 0.703
3nls 016Gag-Pol polyprotein 3.4.23.16 0.702
3dcr KVSProtease / 0.701
3nwx KVSGag-Pol polyprotein 3.4.23.16 0.701
1fg6 2NCGag-Pol polyprotein 3.4.23.16 0.700
1mui AB1Protease / 0.699
1sdu MK1Gag-Pol polyprotein 3.4.23.16 0.698
1zsf 0ZSGag-Pol polyprotein 3.4.23.16 0.698
1d4h BEHGag-Pol polyprotein 3.4.23.16 0.697
2pyn 1UNGag-Pol polyprotein 3.4.23.16 0.696
1dw6 0Q4Gag-Pol polyprotein 3.4.23.16 0.695
4gb2 0LQGag-Pol polyprotein 2.7.7.49 0.694
1ec1 BEEGag-Pol polyprotein 3.4.23.16 0.693
4fe6 0TQGag-Pol polyprotein 3.4.23.16 0.693
4qgi ROCGag-Pol polyprotein 3.4.23.16 0.692
3kdd JZQGag-Pol polyprotein 3.4.23.16 0.691
3kf0 3TLGag-Pol polyprotein / 0.691
1sdt MK1Gag-Pol polyprotein 3.4.23.16 0.690
1hpx KNIGag-Pol polyprotein / 0.689
1w5x BE5Gag-Pol polyprotein 3.4.23.16 0.688
3d1x ROCGag-Pol polyprotein 3.4.23.16 0.687
3el1 DR7Gag-Pol polyprotein 3.4.23.16 0.686
2nnk ROCProtease / 0.685
3slz 3TLPutative gag-pro-pol polyprotein / 0.685
1eby BEBGag-Pol polyprotein 3.4.23.16 0.684
2p3d 3TLProtease / 0.682
1ebz BECGag-Pol polyprotein 3.4.23.16 0.680
2upj U02Gag-Pol polyprotein 3.4.23.16 0.679
3cyx ROCGag-Pol polyprotein 3.4.23.16 0.679
3ekx 1UNGag-Pol polyprotein 3.4.23.16 0.678
1daz 0Q4Gag-Pol polyprotein 3.4.23.16 0.677
1ec3 MS3Gag-Pol polyprotein 3.4.23.16 0.677
3fx5 KNIGag-Pol polyprotein 3.4.23.16 0.677
3so9 017Pol protein / 0.677
1ec0 BEDGag-Pol polyprotein 3.4.23.16 0.675
2avs MK1Gag-Pol polyprotein 3.4.23.16 0.675
2xyf G40Gag-Pol polyprotein / 0.675
1d4j MSCGag-Pol polyprotein 3.4.23.16 0.674
2b60 RITPol polyprotein / 0.674
3zpt M8YGag-Pol polyprotein 3.4.23.16 0.674
1tcx IM1Gag-Pol polyprotein 3.4.23.16 0.672
1w5w BE4Gag-Pol polyprotein 3.4.23.16 0.672
1a94 0Q4Gag-Pol polyprotein 3.4.23.16 0.671
3ufn ROCGag-Pol polyprotein / 0.670
1hvi A77Protease / 0.669
1qbt 146Gag-Pol polyprotein 3.4.23.16 0.669
1b6p PI7Gag-Pol polyprotein 3.4.23.16 0.667
1msm JE2Gag-Pol polyprotein 3.4.23.16 0.667
2rkf AB1Pol protein / 0.667
1sdv MK1Gag-Pol polyprotein 3.4.23.16 0.666
2q55 MU0Protease / 0.666
2q64 1UNGag-Pol polyprotein 3.4.23.16 0.666
1ff0 2NCGag-Pol polyprotein 3.4.23.16 0.665
1hih C20Gag-Pol polyprotein / 0.665
1wbm BLLPol protein / 0.665
2q5k AB1Protease / 0.665
2bqv A1AProtease / 0.664
2xye CXGGag-Pol polyprotein / 0.664
3kdc JZPGag-Pol polyprotein 3.4.23.16 0.664
2a1e IPFGag-Pol polyprotein 3.4.23.16 0.663
2cej 1AHPol protein / 0.663
3kfs 3TLGag-Pol polyprotein / 0.661
1jld 0PPGag-Pol polyprotein / 0.659
3qn8 NI7Gag-Pol polyprotein 3.4.23.16 0.659
3s85 LK0Gag-Pol polyprotein / 0.659
1k2b 0Q4Gag-Pol polyprotein 3.4.23.16 0.657
2uy0 HV1Gag-Pol polyprotein 3.4.23.16 0.657
9hvp 0E9Gag-Pol polyprotein / 0.657
2pwr G4GGag-Pol polyprotein 3.4.23.16 0.656
1hxw RITGag-Pol polyprotein / 0.654
3toh 079Gag-Pol polyprotein 2.7.7.49 0.654
1qbs DMPGag-Pol polyprotein 3.4.23.16 0.653
1ebw BEIGag-Pol polyprotein 3.4.23.16 0.652
1hvs A77Gag-Pol polyprotein / 0.652
1mer DMQGag-Pol polyprotein 3.4.23.16 0.652
2qhc AB1Protease / 0.652
1bwb 146Gag-Pol polyprotein 3.4.23.16 0.651
1hsg MK1Gag-Pol polyprotein / 0.651
1ody LP1Gag-Pol polyprotein 3.4.23.16 0.651
3bxr DRRGag-Pol polyprotein 3.4.23.16 0.650
4a6b QG8Gag-Pol polyprotein 3.4.23.16 0.650