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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
3i6o GR6 Gag-Pol polyprotein 3.4.23.16

Complex with similar interaction patterns:

PDB ID HET Uniprot Name EC Number Binding Mode
Similarity
Align
3i6o GR6Gag-Pol polyprotein 3.4.23.16 1.358
4heg G52Gag-Pol polyprotein 3.4.23.16 1.114
3o9a K14Pol polyprotein / 1.112
4hdp G52Gag-Pol polyprotein 3.4.23.16 1.105
3o9f K2DGag-Pol polyprotein / 1.068
2qd7 065Gag-Pol polyprotein 3.4.23.16 1.067
3o9h K2EGag-Pol polyprotein / 1.065
3qaa G04Gag-Pol polyprotein 3.4.23.16 1.063
2i4u DJRProtease / 1.061
4kb9 G79Protease / 1.050
3ecg 065Gag-Pol polyprotein 3.4.23.47 1.048
3st5 G89Gag-Pol polyprotein 3.4.23.16 1.040
1t7i 017Gag-Pol polyprotein 3.4.23.16 1.034
3vf5 031Gag-Pol polyprotein 3.4.23.16 1.030
3o99 K13Pol polyprotein / 1.022
4hdf G52Gag-Pol polyprotein 3.4.23.16 1.020
1t3r 017Gag-Pol polyprotein 3.4.23.16 1.019
3vfb 031Gag-Pol polyprotein 3.4.23.16 1.019
3o9g F53Gag-Pol polyprotein / 1.018
3oy4 017Gag-Pol polyprotein 3.4.23.16 1.014
2qci 065Gag-Pol polyprotein 3.4.23.16 1.011
3vf7 031Gag-Pol polyprotein 3.4.23.16 1.011
2f80 017Gag-Pol polyprotein 3.4.23.16 1.006
2hb3 GRLProtease / 1.006
2f81 017Gag-Pol polyprotein 3.4.23.16 1.005
2qd8 065Gag-Pol polyprotein 3.4.23.16 1.004
4dfg 0JVGag-Pol polyprotein 3.4.23.16 1.002
4dqe 017Gag-Pol polyprotein / 1.002
3o9d K19Pol polyprotein / 1.001
3vfa 031Gag-Pol polyprotein 3.4.23.16 1.001
4djo MK5Pol polyprotein / 1.001
2i4d QFIProtease / 1.000
2i4w KGQProtease / 0.999
4dqb 017Gag-Pol polyprotein / 0.999
3pwm 017Gag-Pol polyprotein 3.4.23.16 0.998
4dqh 017Gag-Pol polyprotein / 0.998
4dqc 017Gag-Pol polyprotein / 0.997
2i4x KGQProtease / 0.996
2z4o 065Gag-Pol polyprotein 3.4.23.16 0.996
3djk G55Gag-Pol polyprotein 3.4.23.16 0.992
3dk1 G05Gag-Pol polyprotein 3.4.23.16 0.992
3o9i A61Gag-Pol polyprotein / 0.990
2ien 017Gag-Pol polyprotein 3.4.23.16 0.989
3r4b 74TGag-Pol polyprotein / 0.985
3t3c 017Gag-Pol polyprotein 3.4.23.16 0.985
4q1w 017Gag-Pol polyprotein 3.4.23.16 0.983
4j54 G52Gag-Pol polyprotein 3.4.23.16 0.981
2qd6 065Gag-Pol polyprotein 3.4.23.16 0.980
3i7e DJRGag-Pol polyprotein / 0.976
3mws 017Pol protein / 0.976
2idw 017Protease / 0.973
3ekt 017Gag-Pol polyprotein 3.4.23.16 0.972
3lzu 017Gag-Pol polyprotein 3.4.23.16 0.969
3o9b K2APol polyprotein / 0.969
3ok9 G52Gag-Pol polyprotein 3.4.23.16 0.969
3em6 017Gag-Pol polyprotein 3.4.23.16 0.966
2fdd 385Pol protein / 0.962
3o9e A60Pol polyprotein / 0.962
4njs G08Protease / 0.962
4ye3 G04Gag-Pol polyprotein 3.4.23.16 0.962
4q1y 017Gag-Pol polyprotein 3.4.23.16 0.956
4dqf 017Gag-Pol polyprotein / 0.954
3sa8 K83Protease / 0.949
3d20 017Gag-Pol polyprotein 3.4.23.16 0.936
3mxd K53Gag-Pol polyprotein 3.4.23.16 0.933
3lzv 017Gag-Pol polyprotein 3.4.23.16 0.932
3lzs 017Gag-Pol polyprotein 3.4.23.16 0.930
4njt 017Protease / 0.929
2i4v DJRV-1 protease / 0.928
2hs1 017Protease / 0.926
4i8z G08Gag-Pol polyprotein 3.4.23.16 0.925
2hs2 017Protease / 0.922
3ucb 017Gag-Pol polyprotein / 0.922
3cyw 017Gag-Pol polyprotein 3.4.23.16 0.921
3d1z 017Gag-Pol polyprotein 3.4.23.16 0.919
3jvy 017Gag-Pol polyprotein 3.4.23.16 0.919
3o9c K20Pol polyprotein / 0.918
2ieo 017Protease / 0.916
3saa 77FProtease / 0.916
4hdb G52Gag-Pol polyprotein 3.4.23.16 0.910
2qi5 MZ7Gag-Pol polyprotein / 0.902
3s54 017Protease / 0.902
4q1x 017Gag-Pol polyprotein 3.4.23.16 0.902
4hla 017Gag-Pol polyprotein 3.4.23.16 0.901
3sa4 F72Protease / 0.899
3jw2 017Gag-Pol polyprotein 3.4.23.16 0.898
3ggu 017Gag-Pol polyprotein 3.4.23.16 0.896
2qi7 MZ9Gag-Pol polyprotein / 0.890
4j55 031Gag-Pol polyprotein 3.4.23.16 0.889
2i0a MUIProtease / 0.888
2qi0 MZ3Gag-Pol polyprotein / 0.888
3oxw 017Gag-Pol polyprotein 3.4.23.16 0.887
2fde 385Gag-Pol polyprotein 3.4.23.16 0.882
2qhy MZ1Gag-Pol polyprotein / 0.879
3sa5 A69Protease / 0.879
3sa9 A68Protease / 0.879
3ec0 GRLGag-Pol polyprotein 3.4.23.47 0.877
3mxe K54Gag-Pol polyprotein 3.4.23.16 0.877
4djr 0KJPol polyprotein / 0.877
3ttp 017Gag-Pol polyprotein 3.4.23.16 0.876
1z1r HBHGag-Pol polyprotein 3.4.23.16 0.875
3gi4 K60Gag-Pol polyprotein / 0.875
2f8g 017Gag-Pol polyprotein 3.4.23.16 0.865
3bvb 017Gag-Pol polyprotein 3.4.23.16 0.862
4djq M86Pol polyprotein / 0.859
2qi4 MZ6Gag-Pol polyprotein / 0.857
2qi6 MZ8Gag-Pol polyprotein / 0.854
3gi5 K62Gag-Pol polyprotein / 0.852
3eky DR7Gag-Pol polyprotein 3.4.23.16 0.851
3sa7 55AProtease / 0.849
3oxx DR7Gag-Pol polyprotein 3.4.23.16 0.844
3gi6 D78Gag-Pol polyprotein / 0.842
1z1h HBBGag-Pol polyprotein 3.4.23.16 0.839
3sa3 23XProtease / 0.839
3sa6 F71Protease / 0.831
3nu6 478Gag-Pol polyprotein 3.4.23.16 0.828
3el4 ROCGag-Pol polyprotein 3.4.23.16 0.822
3sac AF8Protease / 0.820
3oxv 478Gag-Pol polyprotein 3.4.23.16 0.819
2i0d MUTProtease / 0.818
3em3 478Gag-Pol polyprotein 3.4.23.16 0.818
3nu3 478Gag-Pol polyprotein 3.4.23.16 0.818
3sab F78Protease / 0.817
3ekv 478Gag-Pol polyprotein 3.4.23.16 0.816
3el9 DR7Gag-Pol polyprotein 3.4.23.16 0.814
3nuo 478Gag-Pol polyprotein 3.4.23.16 0.813
2psu MUUProtease / 0.806
2qi3 MZ5Gag-Pol polyprotein / 0.805
3nu9 478Gag-Pol polyprotein 3.4.23.16 0.805
2qhz MZ2Gag-Pol polyprotein / 0.803
3nu4 478Gag-Pol polyprotein 3.4.23.16 0.803
1fff 0Q4Gag-Pol polyprotein 3.4.23.16 0.800
3d1y ROCGag-Pol polyprotein 3.4.23.16 0.798
1d4l PI9Gag-Pol polyprotein 3.4.23.16 0.795
3tl9 ROCGag-Pol polyprotein 3.4.23.16 0.783
3ufn ROCGag-Pol polyprotein / 0.783
3nu5 478Gag-Pol polyprotein 3.4.23.16 0.781
2aqu DR7Gag-Pol polyprotein 3.4.23.16 0.780
2pym 1UNGag-Pol polyprotein 3.4.23.16 0.779
4j5j 478Gag-Pol polyprotein 3.4.23.16 0.778
1b6l PI4Gag-Pol polyprotein 3.4.23.16 0.777
2a1e IPFGag-Pol polyprotein 3.4.23.16 0.774
1ida 0POGag-Pol polyprotein 3.4.23.47 0.773
2f3k RO1Protease / 0.770
3ekq ROCGag-Pol polyprotein 3.4.23.16 0.767
1hpv 478Gag-Pol polyprotein / 0.766
2nmy ROCProtease / 0.766
3pwr ROCGag-Pol polyprotein 3.4.23.16 0.766
3nuj 478Gag-Pol polyprotein 3.4.23.16 0.765
3s43 478Protease / 0.763
3em4 DR7Gag-Pol polyprotein 3.4.23.16 0.760
3s85 LK0Gag-Pol polyprotein / 0.760
2psv MUVProtease / 0.757
3kdc JZPGag-Pol polyprotein 3.4.23.16 0.756
3slz 3TLPutative gag-pro-pol polyprotein / 0.752
2nnp ROCProtease / 0.751
3sm2 478Putative gag-pro-pol polyprotein / 0.751
3k4v ROCGag-Pol polyprotein 3.4.23.16 0.749
1yt9 OISGag-Pol polyprotein / 0.747
2p3c 3TLProtease / 0.747
1npa 3NHGag-Pol polyprotein 3.4.23.16 0.743
1npw LGZGag-Pol polyprotein 3.4.23.16 0.743
1t7j 478Gag-Pol polyprotein 3.4.23.16 0.743
1mrw K57Gag-Pol polyprotein 3.4.23.16 0.742
1hvi A77Protease / 0.740
4qgi ROCGag-Pol polyprotein 3.4.23.16 0.740
1ohr 1UNV-1 PROTEASE protein / 0.738
2cem 2AHPol protein / 0.738
2a4f AAUV-1 protease / 0.736
4djp M73Pol polyprotein / 0.736
3el0 1UNGag-Pol polyprotein 3.4.23.16 0.733
4rvj 478Protease / 0.732
1sdt MK1Gag-Pol polyprotein 3.4.23.16 0.729
2bbb HH1Gag-Pol polyprotein 3.4.23.16 0.729
1fg8 0Q4Gag-Pol polyprotein 3.4.23.16 0.727
1sdv MK1Gag-Pol polyprotein 3.4.23.16 0.727
2qak 1UNGag-Pol polyprotein 3.4.23.16 0.726
3ndt ROCGag-Pol polyprotein 3.4.23.16 0.725
1bwa XV6Gag-Pol polyprotein 3.4.23.16 0.724
1ffi 2NCGag-Pol polyprotein 3.4.23.16 0.723
1qbt 146Gag-Pol polyprotein 3.4.23.16 0.723
2cen 4AHProtease / 0.721
3dck KVIProtease / 0.720
1izh Q50Protease / 0.719
2fle AIProtease / 0.719
3d1x ROCGag-Pol polyprotein 3.4.23.16 0.718
3i2l 2NCProtease / 0.718
3jvw DMPGag-Pol polyprotein 3.4.23.16 0.718
3kdb 006Gag-Pol polyprotein 3.4.23.16 0.718
3nyg 2NCGag-Pol polyprotein 3.4.23.16 0.717
2nnk ROCProtease / 0.715
3cyx ROCGag-Pol polyprotein 3.4.23.16 0.715
3s56 ROCProtease / 0.715
4gb2 0LQGag-Pol polyprotein 2.7.7.49 0.715
2b60 RITPol polyprotein / 0.712
3bxr DRRGag-Pol polyprotein 3.4.23.16 0.712
1msn JE2Gag-Pol polyprotein 3.4.23.16 0.709
3nwq 2NCGag-Pol polyprotein 3.4.23.16 0.707
1sbg IM1Gag-Pol polyprotein / 0.705
1bv9 XV6Gag-Pol polyprotein 3.4.23.16 0.704
3nwx KVSGag-Pol polyprotein 3.4.23.16 0.704
1b6p PI7Gag-Pol polyprotein 3.4.23.16 0.703
1t7k BH0Gag-Pol polyprotein 3.4.23.16 0.702
1dw6 0Q4Gag-Pol polyprotein 3.4.23.16 0.701
1fg6 2NCGag-Pol polyprotein 3.4.23.16 0.701
2p3a 3TLPol protein / 0.700
2bb9 AKCGag-Pol polyprotein 3.4.23.16 0.698
1k6t XN1Gag-Pol polyprotein 3.4.23.16 0.697
1m0b 0ZQGag-Pol polyprotein 3.4.23.16 0.697
3bxs DRSGag-Pol polyprotein 3.4.23.16 0.693
2fxe DR7Gag-Pol polyprotein 3.4.23.16 0.692
3dcr KVSProtease / 0.690
3kfn 3TLGag-Pol polyprotein / 0.690
1d4h BEHGag-Pol polyprotein 3.4.23.16 0.689
3nxe 2NCProtease / 0.689
1fej 2NCGag-Pol polyprotein 3.4.23.16 0.686
2q64 1UNGag-Pol polyprotein 3.4.23.16 0.686
4nju TPVProtease / 0.686
1a8g 2Z4Gag-Pol polyprotein 3.4.23.16 0.684
1izi Q50Gag-Pol polyprotein 3.4.23.16 0.684
2q5k AB1Protease / 0.684
1npv L27Gag-Pol polyprotein 3.4.23.16 0.683
1pro A88Gag-Pol polyprotein / 0.682
1idb 0DOGag-Pol polyprotein / 0.681
2q63 1UNGag-Pol polyprotein 3.4.23.16 0.681
3fx5 KNIGag-Pol polyprotein 3.4.23.16 0.681
3so9 017Pol protein / 0.681
1rl8 RITGag-Pol polyprotein 3.4.23.16 0.678
1qbr XV6Gag-Pol polyprotein 3.4.23.16 0.677
2q54 MU1Protease / 0.677
1ff0 2NCGag-Pol polyprotein 3.4.23.16 0.676
1hos PHPGag-Pol polyprotein / 0.676
1jld 0PPGag-Pol polyprotein / 0.676
2q55 MU0Protease / 0.676
1d4j MSCGag-Pol polyprotein 3.4.23.16 0.675
2wl0 5AHGag-Pol polyprotein / 0.675
4fe6 0TQGag-Pol polyprotein 3.4.23.16 0.674
1hxb ROCGag-Pol polyprotein 3.4.23.16 0.673
1kzk JE2Gag-Pol polyprotein 3.4.23.16 0.673
3kfr 3TLGag-Pol polyprotein / 0.672
1w5x BE5Gag-Pol polyprotein 3.4.23.16 0.669
3ixj 586Beta-secretase 1 3.4.23.46 0.669
1d4i BEGGag-Pol polyprotein 3.4.23.16 0.668
2bqv A1AProtease / 0.667
1fgc 2NCGag-Pol polyprotein 3.4.23.16 0.665
1g35 AHFGag-Pol polyprotein 3.4.23.16 0.664
1k1u 0Q4Gag-Pol polyprotein 3.4.23.16 0.664
1ajv NMBGag-Pol polyprotein 3.4.23.16 0.661
1zsf 0ZSGag-Pol polyprotein 3.4.23.16 0.660
4njv RITProtease / 0.660
1ec3 MS3Gag-Pol polyprotein 3.4.23.16 0.659
1hxw RITGag-Pol polyprotein / 0.659
3ndx RITGag-Pol polyprotein 3.4.23.16 0.659
3qn8 NI7Gag-Pol polyprotein 3.4.23.16 0.658
2bpw 1INGag-Pol polyprotein 3.4.23.16 0.657
3qih NI7Gag-Pol polyprotein 3.4.23.16 0.657
4a6b QG8Gag-Pol polyprotein 3.4.23.16 0.657
1dif A85Gag-Pol polyprotein / 0.656
2z54 AB1Gag-Pol polyprotein 3.4.23.16 0.656
3aid ARQGag-Pol polyprotein 3.4.23.16 0.656
3kf0 3TLGag-Pol polyprotein / 0.655
1a94 0Q4Gag-Pol polyprotein 3.4.23.16 0.654
3gga GGWGag-Pol polyprotein / 0.654
3tog 079Gag-Pol polyprotein 2.7.7.49 0.654
1ec1 BEEGag-Pol polyprotein 3.4.23.16 0.653
2p3d 3TLProtease / 0.653
1eby BEBGag-Pol polyprotein 3.4.23.16 0.652
1sdu MK1Gag-Pol polyprotein 3.4.23.16 0.652
3tof 076Gag-Pol polyprotein 2.7.7.49 0.652
1eag A70Candidapepsin-2 3.4.23.24 0.651