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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
2f80 017 Gag-Pol polyprotein 3.4.23.16

Complex with similar interaction patterns:

PDB ID HET Uniprot Name EC Number Binding Mode
Similarity
Align
2f80 017Gag-Pol polyprotein 3.4.23.16 1.319
3pwm 017Gag-Pol polyprotein 3.4.23.16 1.218
3d20 017Gag-Pol polyprotein 3.4.23.16 1.213
3jvy 017Gag-Pol polyprotein 3.4.23.16 1.186
2f81 017Gag-Pol polyprotein 3.4.23.16 1.178
4dqe 017Gag-Pol polyprotein / 1.170
1t3r 017Gag-Pol polyprotein 3.4.23.16 1.169
2qci 065Gag-Pol polyprotein 3.4.23.16 1.169
3lzv 017Gag-Pol polyprotein 3.4.23.16 1.164
3o9e A60Pol polyprotein / 1.164
3oy4 017Gag-Pol polyprotein 3.4.23.16 1.164
4heg G52Gag-Pol polyprotein 3.4.23.16 1.163
4dqb 017Gag-Pol polyprotein / 1.162
4dqc 017Gag-Pol polyprotein / 1.162
4q1w 017Gag-Pol polyprotein 3.4.23.16 1.156
3o9b K2APol polyprotein / 1.132
3ok9 G52Gag-Pol polyprotein 3.4.23.16 1.132
2ieo 017Protease / 1.131
2ien 017Gag-Pol polyprotein 3.4.23.16 1.130
3st5 G89Gag-Pol polyprotein 3.4.23.16 1.124
3ecg 065Gag-Pol polyprotein 3.4.23.47 1.123
3mws 017Pol protein / 1.123
3t3c 017Gag-Pol polyprotein 3.4.23.16 1.123
2z4o 065Gag-Pol polyprotein 3.4.23.16 1.122
3qaa G04Gag-Pol polyprotein 3.4.23.16 1.119
4dqf 017Gag-Pol polyprotein / 1.117
3o99 K13Pol polyprotein / 1.113
3jw2 017Gag-Pol polyprotein 3.4.23.16 1.112
3lzu 017Gag-Pol polyprotein 3.4.23.16 1.111
3ucb 017Gag-Pol polyprotein / 1.110
3o9a K14Pol polyprotein / 1.109
3o9g F53Gag-Pol polyprotein / 1.102
2qd8 065Gag-Pol polyprotein 3.4.23.16 1.100
4hdb G52Gag-Pol polyprotein 3.4.23.16 1.100
2hb3 GRLProtease / 1.097
3oxw 017Gag-Pol polyprotein 3.4.23.16 1.097
3cyw 017Gag-Pol polyprotein 3.4.23.16 1.096
3o9h K2EGag-Pol polyprotein / 1.094
3em6 017Gag-Pol polyprotein 3.4.23.16 1.092
4q1y 017Gag-Pol polyprotein 3.4.23.16 1.090
1t7i 017Gag-Pol polyprotein 3.4.23.16 1.088
2hs1 017Protease / 1.087
2i4u DJRProtease / 1.085
2f8g 017Gag-Pol polyprotein 3.4.23.16 1.081
4njt 017Protease / 1.078
4kb9 G79Protease / 1.072
3vfa 031Gag-Pol polyprotein 3.4.23.16 1.071
4dqh 017Gag-Pol polyprotein / 1.071
2qd6 065Gag-Pol polyprotein 3.4.23.16 1.064
3s54 017Protease / 1.062
3d1z 017Gag-Pol polyprotein 3.4.23.16 1.060
3djk G55Gag-Pol polyprotein 3.4.23.16 1.058
2qd7 065Gag-Pol polyprotein 3.4.23.16 1.055
3dk1 G05Gag-Pol polyprotein 3.4.23.16 1.054
4hdp G52Gag-Pol polyprotein 3.4.23.16 1.052
4dfg 0JVGag-Pol polyprotein 3.4.23.16 1.050
3o9f K2DGag-Pol polyprotein / 1.044
3r4b 74TGag-Pol polyprotein / 1.040
3o9c K20Pol polyprotein / 1.039
4hdf G52Gag-Pol polyprotein 3.4.23.16 1.030
4njs G08Protease / 1.030
3o9d K19Pol polyprotein / 1.026
4q1x 017Gag-Pol polyprotein 3.4.23.16 1.022
3vf5 031Gag-Pol polyprotein 3.4.23.16 1.021
3o9i A61Gag-Pol polyprotein / 1.017
2hs2 017Protease / 1.015
2idw 017Protease / 1.015
3ekv 478Gag-Pol polyprotein 3.4.23.16 1.014
4i8z G08Gag-Pol polyprotein 3.4.23.16 1.008
3i6o GR6Gag-Pol polyprotein 3.4.23.16 1.006
3nu6 478Gag-Pol polyprotein 3.4.23.16 1.005
3ec0 GRLGag-Pol polyprotein 3.4.23.47 1.004
3vf7 031Gag-Pol polyprotein 3.4.23.16 0.997
3ggu 017Gag-Pol polyprotein 3.4.23.16 0.994
3vfb 031Gag-Pol polyprotein 3.4.23.16 0.992
2i4d QFIProtease / 0.991
3lzs 017Gag-Pol polyprotein 3.4.23.16 0.991
3em3 478Gag-Pol polyprotein 3.4.23.16 0.989
3nu9 478Gag-Pol polyprotein 3.4.23.16 0.988
3nuo 478Gag-Pol polyprotein 3.4.23.16 0.986
3sa8 K83Protease / 0.980
4hla 017Gag-Pol polyprotein 3.4.23.16 0.979
3ekt 017Gag-Pol polyprotein 3.4.23.16 0.976
2fdd 385Pol protein / 0.966
4ye3 G04Gag-Pol polyprotein 3.4.23.16 0.965
3nuj 478Gag-Pol polyprotein 3.4.23.16 0.962
3nu4 478Gag-Pol polyprotein 3.4.23.16 0.959
3sa9 A68Protease / 0.951
4j54 G52Gag-Pol polyprotein 3.4.23.16 0.951
2i4x KGQProtease / 0.945
2qi5 MZ7Gag-Pol polyprotein / 0.939
3i7e DJRGag-Pol polyprotein / 0.939
2i4v DJRV-1 protease / 0.936
2qi4 MZ6Gag-Pol polyprotein / 0.930
2psu MUUProtease / 0.925
3oxv 478Gag-Pol polyprotein 3.4.23.16 0.920
3sab F78Protease / 0.917
3nu3 478Gag-Pol polyprotein 3.4.23.16 0.916
4djp M73Pol polyprotein / 0.916
4djo MK5Pol polyprotein / 0.915
4j5j 478Gag-Pol polyprotein 3.4.23.16 0.915
3sa7 55AProtease / 0.909
2qhy MZ1Gag-Pol polyprotein / 0.907
3sac AF8Protease / 0.904
1z1r HBHGag-Pol polyprotein 3.4.23.16 0.901
3saa 77FProtease / 0.900
1d4l PI9Gag-Pol polyprotein 3.4.23.16 0.899
4j55 031Gag-Pol polyprotein 3.4.23.16 0.899
4rvj 478Protease / 0.895
1z1h HBBGag-Pol polyprotein 3.4.23.16 0.894
4djr 0KJPol polyprotein / 0.892
3sa5 A69Protease / 0.889
3s43 478Protease / 0.887
3sa3 23XProtease / 0.881
3mxe K54Gag-Pol polyprotein 3.4.23.16 0.878
2qi6 MZ8Gag-Pol polyprotein / 0.876
3nu5 478Gag-Pol polyprotein 3.4.23.16 0.870
3sa6 F71Protease / 0.870
3gi5 K62Gag-Pol polyprotein / 0.868
3el1 DR7Gag-Pol polyprotein 3.4.23.16 0.862
2qi0 MZ3Gag-Pol polyprotein / 0.860
3gi6 D78Gag-Pol polyprotein / 0.858
3sm2 478Putative gag-pro-pol polyprotein / 0.857
4djq M86Pol polyprotein / 0.856
2qi7 MZ9Gag-Pol polyprotein / 0.854
3sa4 F72Protease / 0.850
3oxx DR7Gag-Pol polyprotein 3.4.23.16 0.849
2fde 385Gag-Pol polyprotein 3.4.23.16 0.845
1yt9 OISGag-Pol polyprotein / 0.839
2i0a MUIProtease / 0.837
2i0d MUTProtease / 0.832
3eky DR7Gag-Pol polyprotein 3.4.23.16 0.832
3gi4 K60Gag-Pol polyprotein / 0.832
3el9 DR7Gag-Pol polyprotein 3.4.23.16 0.831
2qhz MZ2Gag-Pol polyprotein / 0.830
1npv L27Gag-Pol polyprotein 3.4.23.16 0.825
2qi3 MZ5Gag-Pol polyprotein / 0.823
1izh Q50Protease / 0.818
2fxe DR7Gag-Pol polyprotein 3.4.23.16 0.818
3tl9 ROCGag-Pol polyprotein 3.4.23.16 0.798
2qak 1UNGag-Pol polyprotein 3.4.23.16 0.795
2bb9 AKCGag-Pol polyprotein 3.4.23.16 0.788
2q63 1UNGag-Pol polyprotein 3.4.23.16 0.784
3s85 LK0Gag-Pol polyprotein / 0.782
2aqu DR7Gag-Pol polyprotein 3.4.23.16 0.780
1hih C20Gag-Pol polyprotein / 0.779
3kfn 3TLGag-Pol polyprotein / 0.775
2p3b 3TLV-1 PROTEASE protein / 0.769
2p3b 3TLV-1 protease / 0.769
3em4 DR7Gag-Pol polyprotein 3.4.23.16 0.769
2psv MUVProtease / 0.768
4fe6 0TQGag-Pol polyprotein 3.4.23.16 0.768
3kfr 3TLGag-Pol polyprotein / 0.767
1b6l PI4Gag-Pol polyprotein 3.4.23.16 0.763
1hpv 478Gag-Pol polyprotein / 0.763
3k4v ROCGag-Pol polyprotein 3.4.23.16 0.753
1k6t XN1Gag-Pol polyprotein 3.4.23.16 0.750
3kfs 3TLGag-Pol polyprotein / 0.750
2nmy ROCProtease / 0.748
1k2c 0Q4Gag-Pol polyprotein 3.4.23.16 0.747
3el0 1UNGag-Pol polyprotein 3.4.23.16 0.746
2pym 1UNGag-Pol polyprotein 3.4.23.16 0.744
3bxr DRRGag-Pol polyprotein 3.4.23.16 0.744
2hc0 AB2Protease / 0.742
2i4w KGQProtease / 0.742
1hvk A79Gag-Pol polyprotein / 0.741
1izi Q50Gag-Pol polyprotein 3.4.23.16 0.740
2avv MK1Gag-Pol polyprotein 3.4.23.16 0.740
2fle AIProtease / 0.740
3el4 ROCGag-Pol polyprotein 3.4.23.16 0.739
3s56 ROCProtease / 0.739
3pwr ROCGag-Pol polyprotein 3.4.23.16 0.736
3d1y ROCGag-Pol polyprotein 3.4.23.16 0.735
3nwx KVSGag-Pol polyprotein 3.4.23.16 0.735
2nnp ROCProtease / 0.734
2q64 1UNGag-Pol polyprotein 3.4.23.16 0.731
1ida 0POGag-Pol polyprotein 3.4.23.47 0.730
2nnk ROCProtease / 0.728
1npa 3NHGag-Pol polyprotein 3.4.23.16 0.727
1npw LGZGag-Pol polyprotein 3.4.23.16 0.727
1mrw K57Gag-Pol polyprotein 3.4.23.16 0.721
3ekw DR7Gag-Pol polyprotein 3.4.23.16 0.721
1sdt MK1Gag-Pol polyprotein 3.4.23.16 0.717
3ndu ROCGag-Pol polyprotein 3.4.23.16 0.717
4qgi ROCGag-Pol polyprotein 3.4.23.16 0.717
1b6p PI7Gag-Pol polyprotein 3.4.23.16 0.716
1eby BEBGag-Pol polyprotein 3.4.23.16 0.716
1sdv MK1Gag-Pol polyprotein 3.4.23.16 0.715
1tcx IM1Gag-Pol polyprotein 3.4.23.16 0.715
2p3c 3TLProtease / 0.715
3slz 3TLPutative gag-pro-pol polyprotein / 0.713
1d4h BEHGag-Pol polyprotein 3.4.23.16 0.711
1fff 0Q4Gag-Pol polyprotein 3.4.23.16 0.711
1mtr PI6Gag-Pol polyprotein 3.4.23.16 0.710
3ekp 478Gag-Pol polyprotein 3.4.23.16 0.710
1pro A88Gag-Pol polyprotein / 0.709
1d4i BEGGag-Pol polyprotein 3.4.23.16 0.708
2a1e IPFGag-Pol polyprotein 3.4.23.16 0.705
1bdr IM1Gag-Pol polyprotein 3.4.23.16 0.704
1k2b 0Q4Gag-Pol polyprotein 3.4.23.16 0.703
1mrx K57Gag-Pol polyprotein 3.4.23.16 0.703
2p3d 3TLProtease / 0.703
1ffi 2NCGag-Pol polyprotein 3.4.23.16 0.702
1hii C20Gag-Pol polyprotein / 0.702
4k4p 3TLGag-Pol polyprotein / 0.702
1jld 0PPGag-Pol polyprotein / 0.701
1sbg IM1Gag-Pol polyprotein / 0.701
1d4j MSCGag-Pol polyprotein 3.4.23.16 0.700
1b6k PI5Gag-Pol polyprotein 3.4.23.16 0.698
1hvr XK2Gag-Pol polyprotein / 0.698
3ekq ROCGag-Pol polyprotein 3.4.23.16 0.698
3gga GGWGag-Pol polyprotein / 0.698
1ajv NMBGag-Pol polyprotein 3.4.23.16 0.697
1hiv 1ZKGag-Pol polyprotein / 0.697
1odw 0E8Gag-Pol polyprotein 3.4.23.16 0.697
2pwc G3GGag-Pol polyprotein 3.4.23.16 0.697
1bv7 XV6Gag-Pol polyprotein 3.4.23.16 0.695
1fg6 2NCGag-Pol polyprotein 3.4.23.16 0.695
1hvj A78Gag-Pol polyprotein / 0.694
3hzc 2NCProtease / 0.694
3kf0 3TLGag-Pol polyprotein / 0.694
3qp0 NI8Gag-Pol polyprotein 3.4.23.16 0.694
1ec1 BEEGag-Pol polyprotein 3.4.23.16 0.693
1siv PSIGag-Pol polyprotein / 0.692
2pqz G0GGag-Pol polyprotein 3.4.23.16 0.692
1sdu MK1Gag-Pol polyprotein 3.4.23.16 0.691
2bpw 1INGag-Pol polyprotein 3.4.23.16 0.691
2q54 MU1Protease / 0.691
3i2l 2NCProtease / 0.690
1m0b 0ZQGag-Pol polyprotein 3.4.23.16 0.689
2xyf G40Gag-Pol polyprotein / 0.689
1ff0 2NCGag-Pol polyprotein 3.4.23.16 0.687
1fgc 2NCGag-Pol polyprotein 3.4.23.16 0.687
3bvb 017Gag-Pol polyprotein 3.4.23.16 0.686
1meu DMPGag-Pol polyprotein 3.4.23.16 0.685
1rl8 RITGag-Pol polyprotein 3.4.23.16 0.685
2avs MK1Gag-Pol polyprotein 3.4.23.16 0.684
2qi1 MZ4Gag-Pol polyprotein / 0.684
2r3t G4GGag-Pol polyprotein 3.4.23.16 0.684
3nyg 2NCGag-Pol polyprotein 3.4.23.16 0.683
3qn8 NI7Gag-Pol polyprotein 3.4.23.16 0.683
1iiq 0ZRGag-Pol polyprotein 3.4.23.16 0.682
3ttp 017Gag-Pol polyprotein 3.4.23.16 0.682
3ndx RITGag-Pol polyprotein 3.4.23.16 0.681
2r43 G3GGag-Pol polyprotein 3.4.23.16 0.680
3bgb LJGGag-Pol polyprotein 3.4.23.16 0.679
2a4f AAUV-1 protease / 0.676
1c6y MK1Protease / 0.675
1ivq 0PXGag-Pol polyprotein / 0.675
2cej 1AHPol protein / 0.675
1fej 2NCGag-Pol polyprotein 3.4.23.16 0.674
1ohr 1UNV-1 PROTEASE protein / 0.674
2rkf AB1Pol protein / 0.674
2bpx MK1Gag-Pol polyprotein 3.4.23.16 0.673
3d1x ROCGag-Pol polyprotein 3.4.23.16 0.673
1bdq IM1Gag-Pol polyprotein 3.4.23.16 0.672
1w5y BE6Gag-Pol polyprotein 3.4.23.16 0.672
1ebw BEIGag-Pol polyprotein 3.4.23.16 0.669
3so9 017Pol protein / 0.669
2avm 2NCGag-Pol polyprotein 3.4.23.16 0.668
3dck KVIProtease / 0.668
1dw6 0Q4Gag-Pol polyprotein 3.4.23.16 0.667
1hsh MK1Gag-Pol polyprotein / 0.666
3kdb 006Gag-Pol polyprotein 3.4.23.16 0.666
1a94 0Q4Gag-Pol polyprotein 3.4.23.16 0.665
1ec2 BEJGag-Pol polyprotein 3.4.23.16 0.665
1fg8 0Q4Gag-Pol polyprotein 3.4.23.16 0.664
2fxd DR7Pol polyprotein / 0.664
2qnq QN3Gag-Pol polyprotein 3.4.23.16 0.663
1d4k PI8Gag-Pol polyprotein 3.4.23.16 0.662
2pyn 1UNGag-Pol polyprotein 3.4.23.16 0.662
1ajx AH1Gag-Pol polyprotein 3.4.23.16 0.661
2qnp QN2Gag-Pol polyprotein 3.4.23.16 0.661
1idb 0DOGag-Pol polyprotein / 0.660
1sh9 RITGag-Pol polyprotein 3.4.23.16 0.660
1vij BAYGag-Pol polyprotein / 0.660
1a8g 2Z4Gag-Pol polyprotein 3.4.23.16 0.657
1dmp DMQGag-Pol polyprotein 3.4.23.16 0.656
2z54 AB1Gag-Pol polyprotein 3.4.23.16 0.656
1hvi A77Protease / 0.654
3dm6 757Beta-secretase 1 3.4.23.46 0.654
1hwr 216Gag-Pol polyprotein 3.4.23.16 0.653
2bpy 3INGag-Pol polyprotein 3.4.23.16 0.653
2pwr G4GGag-Pol polyprotein 3.4.23.16 0.653
2xye CXGGag-Pol polyprotein / 0.653
1w5w BE4Gag-Pol polyprotein 3.4.23.16 0.652
3ogq AB1Pol polyprotein / 0.652
3ufn ROCGag-Pol polyprotein / 0.652
1hxw RITGag-Pol polyprotein / 0.651