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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
2qi5 MZ7 Gag-Pol polyprotein

Complex with similar interaction patterns:

PDB ID HET Uniprot Name EC Number Binding Mode
Similarity
Align
2qi5 MZ7Gag-Pol polyprotein / 1.310
3sa3 23XProtease / 1.154
3sa9 A68Protease / 1.138
3sa7 55AProtease / 1.120
3sab F78Protease / 1.059
1z1h HBBGag-Pol polyprotein 3.4.23.16 1.023
3o9d K19Pol polyprotein / 1.020
3o9h K2EGag-Pol polyprotein / 1.011
4djp M73Pol polyprotein / 1.009
3eky DR7Gag-Pol polyprotein 3.4.23.16 1.005
3r4b 74TGag-Pol polyprotein / 1.005
4kb9 G79Protease / 1.003
3o9i A61Gag-Pol polyprotein / 0.995
3o9f K2DGag-Pol polyprotein / 0.988
4djr 0KJPol polyprotein / 0.979
3sa5 A69Protease / 0.977
4hdp G52Gag-Pol polyprotein 3.4.23.16 0.971
2qi4 MZ6Gag-Pol polyprotein / 0.962
2qi0 MZ3Gag-Pol polyprotein / 0.960
2qhy MZ1Gag-Pol polyprotein / 0.957
3el9 DR7Gag-Pol polyprotein 3.4.23.16 0.950
3sa4 F72Protease / 0.950
4hdf G52Gag-Pol polyprotein 3.4.23.16 0.950
3sa8 K83Protease / 0.949
2i0a MUIProtease / 0.945
4heg G52Gag-Pol polyprotein 3.4.23.16 0.945
3qaa G04Gag-Pol polyprotein 3.4.23.16 0.942
3mxe K54Gag-Pol polyprotein 3.4.23.16 0.941
3oy4 017Gag-Pol polyprotein 3.4.23.16 0.941
2f80 017Gag-Pol polyprotein 3.4.23.16 0.939
3el1 DR7Gag-Pol polyprotein 3.4.23.16 0.938
3o9b K2APol polyprotein / 0.938
1t3r 017Gag-Pol polyprotein 3.4.23.16 0.937
3o9g F53Gag-Pol polyprotein / 0.937
2qci 065Gag-Pol polyprotein 3.4.23.16 0.931
3em3 478Gag-Pol polyprotein 3.4.23.16 0.931
2fxe DR7Gag-Pol polyprotein 3.4.23.16 0.928
4dfg 0JVGag-Pol polyprotein 3.4.23.16 0.927
2qd8 065Gag-Pol polyprotein 3.4.23.16 0.925
3o9e A60Pol polyprotein / 0.924
3ekv 478Gag-Pol polyprotein 3.4.23.16 0.923
3lzv 017Gag-Pol polyprotein 3.4.23.16 0.922
2qi6 MZ8Gag-Pol polyprotein / 0.921
4dqh 017Gag-Pol polyprotein / 0.921
4q1w 017Gag-Pol polyprotein 3.4.23.16 0.920
2psu MUUProtease / 0.917
3pwm 017Gag-Pol polyprotein 3.4.23.16 0.917
3ok9 G52Gag-Pol polyprotein 3.4.23.16 0.910
2hb3 GRLProtease / 0.909
1t7i 017Gag-Pol polyprotein 3.4.23.16 0.903
3o99 K13Pol polyprotein / 0.903
3saa 77FProtease / 0.903
3i6o GR6Gag-Pol polyprotein 3.4.23.16 0.902
3vfa 031Gag-Pol polyprotein 3.4.23.16 0.901
4dqb 017Gag-Pol polyprotein / 0.900
3oxx DR7Gag-Pol polyprotein 3.4.23.16 0.899
2q54 MU1Protease / 0.897
2hs1 017Protease / 0.895
3dk1 G05Gag-Pol polyprotein 3.4.23.16 0.895
3ecg 065Gag-Pol polyprotein 3.4.23.47 0.895
2z4o 065Gag-Pol polyprotein 3.4.23.16 0.890
3mws 017Pol protein / 0.890
3vf7 031Gag-Pol polyprotein 3.4.23.16 0.890
4dqe 017Gag-Pol polyprotein / 0.888
2qd7 065Gag-Pol polyprotein 3.4.23.16 0.886
3em4 DR7Gag-Pol polyprotein 3.4.23.16 0.886
3ec0 GRLGag-Pol polyprotein 3.4.23.47 0.883
4hdb G52Gag-Pol polyprotein 3.4.23.16 0.882
4dqf 017Gag-Pol polyprotein / 0.880
3d20 017Gag-Pol polyprotein 3.4.23.16 0.879
3nu9 478Gag-Pol polyprotein 3.4.23.16 0.878
3nuo 478Gag-Pol polyprotein 3.4.23.16 0.878
1d4l PI9Gag-Pol polyprotein 3.4.23.16 0.876
4dqc 017Gag-Pol polyprotein / 0.873
3djk G55Gag-Pol polyprotein 3.4.23.16 0.869
2f81 017Gag-Pol polyprotein 3.4.23.16 0.868
3st5 G89Gag-Pol polyprotein 3.4.23.16 0.864
3toh 079Gag-Pol polyprotein 2.7.7.49 0.864
3lzu 017Gag-Pol polyprotein 3.4.23.16 0.862
4i8z G08Gag-Pol polyprotein 3.4.23.16 0.862
1ida 0POGag-Pol polyprotein 3.4.23.47 0.860
3gi4 K60Gag-Pol polyprotein / 0.860
3sac AF8Protease / 0.858
4q1y 017Gag-Pol polyprotein 3.4.23.16 0.858
2aqu DR7Gag-Pol polyprotein 3.4.23.16 0.855
3d1z 017Gag-Pol polyprotein 3.4.23.16 0.854
3oxw 017Gag-Pol polyprotein 3.4.23.16 0.854
4q1x 017Gag-Pol polyprotein 3.4.23.16 0.854
3o9a K14Pol polyprotein / 0.853
3tof 076Gag-Pol polyprotein 2.7.7.49 0.853
2ieo 017Protease / 0.852
3t3c 017Gag-Pol polyprotein 3.4.23.16 0.852
3vfb 031Gag-Pol polyprotein 3.4.23.16 0.852
4k4p 3TLGag-Pol polyprotein / 0.850
1z1r HBHGag-Pol polyprotein 3.4.23.16 0.849
4njs G08Protease / 0.847
2idw 017Protease / 0.846
4j55 031Gag-Pol polyprotein 3.4.23.16 0.845
3mxd K53Gag-Pol polyprotein 3.4.23.16 0.843
3o9c K20Pol polyprotein / 0.842
3nu3 478Gag-Pol polyprotein 3.4.23.16 0.841
2psv MUVProtease / 0.840
3vf5 031Gag-Pol polyprotein 3.4.23.16 0.840
1izh Q50Protease / 0.839
2i4d QFIProtease / 0.838
2hs2 017Protease / 0.837
2ien 017Gag-Pol polyprotein 3.4.23.16 0.837
3nu6 478Gag-Pol polyprotein 3.4.23.16 0.835
1npv L27Gag-Pol polyprotein 3.4.23.16 0.834
2qd6 065Gag-Pol polyprotein 3.4.23.16 0.834
3s43 478Protease / 0.832
2i4x KGQProtease / 0.829
3kfr 3TLGag-Pol polyprotein / 0.828
3ekt 017Gag-Pol polyprotein 3.4.23.16 0.827
3oxv 478Gag-Pol polyprotein 3.4.23.16 0.827
3s85 LK0Gag-Pol polyprotein / 0.825
3em6 017Gag-Pol polyprotein 3.4.23.16 0.824
3gga GGWGag-Pol polyprotein / 0.820
3s54 017Protease / 0.818
3nu4 478Gag-Pol polyprotein 3.4.23.16 0.817
3jw2 017Gag-Pol polyprotein 3.4.23.16 0.816
3nu5 478Gag-Pol polyprotein 3.4.23.16 0.816
3cyw 017Gag-Pol polyprotein 3.4.23.16 0.813
3ucb 017Gag-Pol polyprotein / 0.813
3tog 079Gag-Pol polyprotein 2.7.7.49 0.809
4njt 017Protease / 0.809
3i7e DJRGag-Pol polyprotein / 0.808
4ye3 G04Gag-Pol polyprotein 3.4.23.16 0.808
3gi6 D78Gag-Pol polyprotein / 0.807
3nuj 478Gag-Pol polyprotein 3.4.23.16 0.806
3gi5 K62Gag-Pol polyprotein / 0.805
1a8g 2Z4Gag-Pol polyprotein 3.4.23.16 0.804
1hpv 478Gag-Pol polyprotein / 0.804
3ggu 017Gag-Pol polyprotein 3.4.23.16 0.803
1hih C20Gag-Pol polyprotein / 0.802
3dcr KVSProtease / 0.802
4j54 G52Gag-Pol polyprotein 3.4.23.16 0.802
2f8g 017Gag-Pol polyprotein 3.4.23.16 0.800
3jvy 017Gag-Pol polyprotein 3.4.23.16 0.800
2p3b 3TLV-1 PROTEASE protein / 0.798
2p3b 3TLV-1 protease / 0.798
2qak 1UNGag-Pol polyprotein 3.4.23.16 0.796
1tcx IM1Gag-Pol polyprotein 3.4.23.16 0.793
4djo MK5Pol polyprotein / 0.793
1hvk A79Gag-Pol polyprotein / 0.792
2i4w KGQProtease / 0.792
2q63 1UNGag-Pol polyprotein 3.4.23.16 0.791
3ndx RITGag-Pol polyprotein 3.4.23.16 0.789
4djq M86Pol polyprotein / 0.787
2fle AIProtease / 0.784
2qi3 MZ5Gag-Pol polyprotein / 0.784
2fdd 385Pol protein / 0.783
2i0d MUTProtease / 0.782
3i2l 2NCProtease / 0.779
2p3c 3TLProtease / 0.778
3ndw RITGag-Pol polyprotein 3.4.23.16 0.778
1fg6 2NCGag-Pol polyprotein 3.4.23.16 0.777
3sm2 478Putative gag-pro-pol polyprotein / 0.776
2nmy ROCProtease / 0.775
1sdu MK1Gag-Pol polyprotein 3.4.23.16 0.773
2fxd DR7Pol polyprotein / 0.773
3d1x ROCGag-Pol polyprotein 3.4.23.16 0.773
4j5j 478Gag-Pol polyprotein 3.4.23.16 0.773
1mtr PI6Gag-Pol polyprotein 3.4.23.16 0.772
1sdt MK1Gag-Pol polyprotein 3.4.23.16 0.771
3bxr DRRGag-Pol polyprotein 3.4.23.16 0.770
1hxw RITGag-Pol polyprotein / 0.769
3k4v ROCGag-Pol polyprotein 3.4.23.16 0.768
2p3a 3TLPol protein / 0.765
1hpx KNIGag-Pol polyprotein / 0.764
1hvl A76Gag-Pol polyprotein / 0.764
3nwx KVSGag-Pol polyprotein 3.4.23.16 0.764
2wl0 5AHGag-Pol polyprotein / 0.762
1daz 0Q4Gag-Pol polyprotein 3.4.23.16 0.761
3tl9 ROCGag-Pol polyprotein 3.4.23.16 0.761
1iiq 0ZRGag-Pol polyprotein 3.4.23.16 0.760
2pk6 O33V-1 protease / 0.760
1n49 RITGag-Pol polyprotein 3.4.23.16 0.759
2nnk ROCProtease / 0.759
1ec1 BEEGag-Pol polyprotein 3.4.23.16 0.758
2avs MK1Gag-Pol polyprotein 3.4.23.16 0.758
3lzs 017Gag-Pol polyprotein 3.4.23.16 0.758
2bb9 AKCGag-Pol polyprotein 3.4.23.16 0.757
1fff 0Q4Gag-Pol polyprotein 3.4.23.16 0.756
3d1y ROCGag-Pol polyprotein 3.4.23.16 0.756
3kf0 3TLGag-Pol polyprotein / 0.756
1sbg IM1Gag-Pol polyprotein / 0.755
2a4f AAUV-1 protease / 0.755
2cen 4AHProtease / 0.755
3ufn ROCGag-Pol polyprotein / 0.755
2cem 2AHPol protein / 0.754
2qhz MZ2Gag-Pol polyprotein / 0.754
1ody LP1Gag-Pol polyprotein 3.4.23.16 0.750
2q55 MU0Protease / 0.750
3cyx ROCGag-Pol polyprotein 3.4.23.16 0.749
1sdv MK1Gag-Pol polyprotein 3.4.23.16 0.746
1siv PSIGag-Pol polyprotein / 0.746
3hzc 2NCProtease / 0.745
2f3k RO1Protease / 0.743
2pym 1UNGag-Pol polyprotein 3.4.23.16 0.743
1rl8 RITGag-Pol polyprotein 3.4.23.16 0.742
3kfn 3TLGag-Pol polyprotein / 0.741
2avv MK1Gag-Pol polyprotein 3.4.23.16 0.740
1ajx AH1Gag-Pol polyprotein 3.4.23.16 0.738
1hvj A78Gag-Pol polyprotein / 0.738
1hii C20Gag-Pol polyprotein / 0.737
4rvj 478Protease / 0.736
1a94 0Q4Gag-Pol polyprotein 3.4.23.16 0.735
1ohr 1UNV-1 PROTEASE protein / 0.735
3sa6 F71Protease / 0.734
4hla 017Gag-Pol polyprotein 3.4.23.16 0.734
1yt9 OISGag-Pol polyprotein / 0.732
1bdr IM1Gag-Pol polyprotein 3.4.23.16 0.731
1ffi 2NCGag-Pol polyprotein 3.4.23.16 0.729
1m0b 0ZQGag-Pol polyprotein 3.4.23.16 0.729
9hvp 0E9Gag-Pol polyprotein / 0.728
2a1e IPFGag-Pol polyprotein 3.4.23.16 0.727
2qi7 MZ9Gag-Pol polyprotein / 0.727
1k2c 0Q4Gag-Pol polyprotein 3.4.23.16 0.726
3slz 3TLPutative gag-pro-pol polyprotein / 0.726
1bv9 XV6Gag-Pol polyprotein 3.4.23.16 0.725
2fde 385Gag-Pol polyprotein 3.4.23.16 0.725
1k6t XN1Gag-Pol polyprotein 3.4.23.16 0.724
1mrw K57Gag-Pol polyprotein 3.4.23.16 0.724
3ekq ROCGag-Pol polyprotein 3.4.23.16 0.721
1b6p PI7Gag-Pol polyprotein 3.4.23.16 0.717
1k1u 0Q4Gag-Pol polyprotein 3.4.23.16 0.717
3zps EQMGag-Pol polyprotein 3.4.23.16 0.717
1ebk 0Q4Gag-Pol polyprotein 3.4.23.16 0.716
1k2b 0Q4Gag-Pol polyprotein 3.4.23.16 0.715
1bwa XV6Gag-Pol polyprotein 3.4.23.16 0.714
1ec3 MS3Gag-Pol polyprotein 3.4.23.16 0.713
1hxb ROCGag-Pol polyprotein 3.4.23.16 0.711
2q64 1UNGag-Pol polyprotein 3.4.23.16 0.711
3nyg 2NCGag-Pol polyprotein 3.4.23.16 0.711
1ec2 BEJGag-Pol polyprotein 3.4.23.16 0.710
1pro A88Gag-Pol polyprotein / 0.710
2hc0 AB2Protease / 0.710
3ndt ROCGag-Pol polyprotein 3.4.23.16 0.709
3bxs DRSGag-Pol polyprotein 3.4.23.16 0.708
3kfs 3TLGag-Pol polyprotein / 0.708
3pwr ROCGag-Pol polyprotein 3.4.23.16 0.708
3s56 ROCProtease / 0.707
3ekw DR7Gag-Pol polyprotein 3.4.23.16 0.705
2fmb LP1Reverse transcriptase / 0.703
1a9m U0EGag-Pol polyprotein / 0.701
1bdq IM1Gag-Pol polyprotein 3.4.23.16 0.700
3nwq 2NCGag-Pol polyprotein 3.4.23.16 0.700
1mer DMQGag-Pol polyprotein 3.4.23.16 0.699
1b6k PI5Gag-Pol polyprotein 3.4.23.16 0.698
1fmb HYBPol polyprotein / 0.697
1b6l PI4Gag-Pol polyprotein 3.4.23.16 0.694
1g35 AHFGag-Pol polyprotein 3.4.23.16 0.694
1hsh MK1Gag-Pol polyprotein / 0.694
2p3d 3TLProtease / 0.693
3bva 2NCGag-Pol polyprotein 3.4.23.16 0.692
1npa 3NHGag-Pol polyprotein 3.4.23.16 0.691
1npw LGZGag-Pol polyprotein 3.4.23.16 0.691
1qbr XV6Gag-Pol polyprotein 3.4.23.16 0.689
2i4u DJRProtease / 0.689
1ivq 0PXGag-Pol polyprotein / 0.688
2b60 RITPol polyprotein / 0.688
3nls 016Gag-Pol polyprotein 3.4.23.16 0.688
2bqv A1AProtease / 0.686
1zsf 0ZSGag-Pol polyprotein 3.4.23.16 0.685
1d4k PI8Gag-Pol polyprotein 3.4.23.16 0.684
1odw 0E8Gag-Pol polyprotein 3.4.23.16 0.684
1qbt 146Gag-Pol polyprotein 3.4.23.16 0.684
2avm 2NCGag-Pol polyprotein 3.4.23.16 0.683
3a2o KNJGag-Pol polyprotein 3.4.23.16 0.682
2i4v DJRV-1 protease / 0.681
1hos PHPGag-Pol polyprotein / 0.679
1zsr 0ZTGag-Pol polyprotein 3.4.23.16 0.679
3fx5 KNIGag-Pol polyprotein 3.4.23.16 0.679
1fgc 2NCGag-Pol polyprotein 3.4.23.16 0.676
1hvr XK2Gag-Pol polyprotein / 0.676
1wbm BLLPol protein / 0.676
2aoe 0Q4Gag-Pol polyprotein 3.4.23.16 0.676
2az8 3TLGag-Pol polyprotein 3.4.23.16 0.675
3kfp 3TLGag-Pol polyprotein / 0.675
3el4 ROCGag-Pol polyprotein 3.4.23.16 0.674
3kdd JZQGag-Pol polyprotein 3.4.23.16 0.673
1eby BEBGag-Pol polyprotein 3.4.23.16 0.672
1w5x BE5Gag-Pol polyprotein 3.4.23.16 0.672
3dck KVIProtease / 0.672
1ajv NMBGag-Pol polyprotein 3.4.23.16 0.671
1hvi A77Protease / 0.671
3ggx GGXGag-Pol polyprotein / 0.671
1wbk 568Pol protein / 0.670
1b6m PI6Gag-Pol polyprotein 3.4.23.16 0.669
1fb7 ROCGag-Pol polyprotein / 0.668
1sh9 RITGag-Pol polyprotein 3.4.23.16 0.668
1ff0 2NCGag-Pol polyprotein 3.4.23.16 0.666
1meu DMPGag-Pol polyprotein 3.4.23.16 0.666
2pk5 075Protease / 0.665
2nnp ROCProtease / 0.663
1c6y MK1Protease / 0.661
1jld 0PPGag-Pol polyprotein / 0.661
1fej 2NCGag-Pol polyprotein 3.4.23.16 0.660
1vij BAYGag-Pol polyprotein / 0.660
2bpw 1INGag-Pol polyprotein 3.4.23.16 0.660
2pyn 1UNGag-Pol polyprotein 3.4.23.16 0.660
1w5v BE3Gag-Pol polyprotein 3.4.23.16 0.659
3so9 017Pol protein / 0.659
1d4i BEGGag-Pol polyprotein 3.4.23.16 0.657
1w5w BE4Gag-Pol polyprotein 3.4.23.16 0.653
2xye CXGGag-Pol polyprotein / 0.653
4qgi ROCGag-Pol polyprotein 3.4.23.16 0.653
2rkf AB1Pol protein / 0.651
2xyf G40Gag-Pol polyprotein / 0.651
3ndu ROCGag-Pol polyprotein 3.4.23.16 0.651
1ec0 BEDGag-Pol polyprotein 3.4.23.16 0.650