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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
2qd6 065 Gag-Pol polyprotein 3.4.23.16

Complex with similar interaction patterns:

PDB ID HET Uniprot Name EC Number Binding Mode
Similarity
Align
2qd6 065Gag-Pol polyprotein 3.4.23.16 1.306
2qci 065Gag-Pol polyprotein 3.4.23.16 1.262
2z4o 065Gag-Pol polyprotein 3.4.23.16 1.239
3ok9 G52Gag-Pol polyprotein 3.4.23.16 1.190
4hdb G52Gag-Pol polyprotein 3.4.23.16 1.189
4heg G52Gag-Pol polyprotein 3.4.23.16 1.183
2qd8 065Gag-Pol polyprotein 3.4.23.16 1.173
3st5 G89Gag-Pol polyprotein 3.4.23.16 1.162
3qaa G04Gag-Pol polyprotein 3.4.23.16 1.143
3o9c K20Pol polyprotein / 1.133
3o9h K2EGag-Pol polyprotein / 1.132
3pwm 017Gag-Pol polyprotein 3.4.23.16 1.131
3o9a K14Pol polyprotein / 1.128
3ecg 065Gag-Pol polyprotein 3.4.23.47 1.111
4kb9 G79Protease / 1.109
3djk G55Gag-Pol polyprotein 3.4.23.16 1.100
4hdp G52Gag-Pol polyprotein 3.4.23.16 1.100
3dk1 G05Gag-Pol polyprotein 3.4.23.16 1.097
2f81 017Gag-Pol polyprotein 3.4.23.16 1.096
3o9f K2DGag-Pol polyprotein / 1.090
4dfg 0JVGag-Pol polyprotein 3.4.23.16 1.073
2ien 017Gag-Pol polyprotein 3.4.23.16 1.066
3r4b 74TGag-Pol polyprotein / 1.065
2f80 017Gag-Pol polyprotein 3.4.23.16 1.064
3o9b K2APol polyprotein / 1.064
3oxw 017Gag-Pol polyprotein 3.4.23.16 1.063
4dqc 017Gag-Pol polyprotein / 1.063
3jvy 017Gag-Pol polyprotein 3.4.23.16 1.062
3d20 017Gag-Pol polyprotein 3.4.23.16 1.061
3vf7 031Gag-Pol polyprotein 3.4.23.16 1.056
2fdd 385Pol protein / 1.051
3o9g F53Gag-Pol polyprotein / 1.048
2i4d QFIProtease / 1.041
1t3r 017Gag-Pol polyprotein 3.4.23.16 1.040
3mws 017Pol protein / 1.037
3vfa 031Gag-Pol polyprotein 3.4.23.16 1.037
3vf5 031Gag-Pol polyprotein 3.4.23.16 1.036
3d1z 017Gag-Pol polyprotein 3.4.23.16 1.035
4dqh 017Gag-Pol polyprotein / 1.033
3bvb 017Gag-Pol polyprotein 3.4.23.16 1.032
3lzs 017Gag-Pol polyprotein 3.4.23.16 1.032
3cyw 017Gag-Pol polyprotein 3.4.23.16 1.029
3oy4 017Gag-Pol polyprotein 3.4.23.16 1.028
4djo MK5Pol polyprotein / 1.028
3em6 017Gag-Pol polyprotein 3.4.23.16 1.027
3lzv 017Gag-Pol polyprotein 3.4.23.16 1.027
4dqe 017Gag-Pol polyprotein / 1.027
2ieo 017Protease / 1.026
4dqb 017Gag-Pol polyprotein / 1.025
2hb3 GRLProtease / 1.023
2idw 017Protease / 1.023
3o9e A60Pol polyprotein / 1.023
4dqf 017Gag-Pol polyprotein / 1.023
3gi4 K60Gag-Pol polyprotein / 1.022
3sa8 K83Protease / 1.018
4hdf G52Gag-Pol polyprotein 3.4.23.16 1.017
2i4w KGQProtease / 1.011
3o9i A61Gag-Pol polyprotein / 1.010
3mxd K53Gag-Pol polyprotein 3.4.23.16 1.008
1t7i 017Gag-Pol polyprotein 3.4.23.16 1.002
3jw2 017Gag-Pol polyprotein 3.4.23.16 1.000
2qi7 MZ9Gag-Pol polyprotein / 0.999
2i4u DJRProtease / 0.998
3o9d K19Pol polyprotein / 0.996
2qd7 065Gag-Pol polyprotein 3.4.23.16 0.992
4njs G08Protease / 0.992
2i0a MUIProtease / 0.991
4q1w 017Gag-Pol polyprotein 3.4.23.16 0.990
2i4v DJRV-1 protease / 0.989
2i0d MUTProtease / 0.987
3gi6 D78Gag-Pol polyprotein / 0.986
4q1y 017Gag-Pol polyprotein 3.4.23.16 0.983
2i4x KGQProtease / 0.980
3i6o GR6Gag-Pol polyprotein 3.4.23.16 0.980
3lzu 017Gag-Pol polyprotein 3.4.23.16 0.978
3s54 017Protease / 0.975
2f8g 017Gag-Pol polyprotein 3.4.23.16 0.974
3vfb 031Gag-Pol polyprotein 3.4.23.16 0.974
3o99 K13Pol polyprotein / 0.972
3ucb 017Gag-Pol polyprotein / 0.972
4djp M73Pol polyprotein / 0.972
3gi5 K62Gag-Pol polyprotein / 0.966
3sa9 A68Protease / 0.963
4j54 G52Gag-Pol polyprotein 3.4.23.16 0.958
2hs1 017Protease / 0.953
3saa 77FProtease / 0.951
4djq M86Pol polyprotein / 0.949
3t3c 017Gag-Pol polyprotein 3.4.23.16 0.948
3ec0 GRLGag-Pol polyprotein 3.4.23.47 0.946
3nu6 478Gag-Pol polyprotein 3.4.23.16 0.946
3nu5 478Gag-Pol polyprotein 3.4.23.16 0.943
3nu4 478Gag-Pol polyprotein 3.4.23.16 0.941
3ekt 017Gag-Pol polyprotein 3.4.23.16 0.935
3nuj 478Gag-Pol polyprotein 3.4.23.16 0.935
2hs2 017Protease / 0.933
3nu3 478Gag-Pol polyprotein 3.4.23.16 0.932
2qi4 MZ6Gag-Pol polyprotein / 0.930
4njt 017Protease / 0.922
3nu9 478Gag-Pol polyprotein 3.4.23.16 0.914
4hla 017Gag-Pol polyprotein 3.4.23.16 0.913
4rvj 478Protease / 0.911
4q1x 017Gag-Pol polyprotein 3.4.23.16 0.908
3em3 478Gag-Pol polyprotein 3.4.23.16 0.907
2qi3 MZ5Gag-Pol polyprotein / 0.906
3ekv 478Gag-Pol polyprotein 3.4.23.16 0.905
3mxe K54Gag-Pol polyprotein 3.4.23.16 0.905
2psu MUUProtease / 0.904
3oxv 478Gag-Pol polyprotein 3.4.23.16 0.888
4ye3 G04Gag-Pol polyprotein 3.4.23.16 0.887
2qi6 MZ8Gag-Pol polyprotein / 0.886
4djr 0KJPol polyprotein / 0.881
3sa7 55AProtease / 0.879
3sab F78Protease / 0.878
4j55 031Gag-Pol polyprotein 3.4.23.16 0.874
3ttp 017Gag-Pol polyprotein 3.4.23.16 0.873
2qi0 MZ3Gag-Pol polyprotein / 0.871
1z1r HBHGag-Pol polyprotein 3.4.23.16 0.867
3nuo 478Gag-Pol polyprotein 3.4.23.16 0.864
2qhy MZ1Gag-Pol polyprotein / 0.863
1d4l PI9Gag-Pol polyprotein 3.4.23.16 0.858
3i7e DJRGag-Pol polyprotein / 0.853
3ggu 017Gag-Pol polyprotein 3.4.23.16 0.849
3sa5 A69Protease / 0.848
3sa3 23XProtease / 0.846
4i8z G08Gag-Pol polyprotein 3.4.23.16 0.846
4j5j 478Gag-Pol polyprotein 3.4.23.16 0.845
1z1h HBBGag-Pol polyprotein 3.4.23.16 0.841
1xl5 190Gag-Pol polyprotein 3.4.23.16 0.839
3s43 478Protease / 0.837
3eky DR7Gag-Pol polyprotein 3.4.23.16 0.836
2qi5 MZ7Gag-Pol polyprotein / 0.834
3sac AF8Protease / 0.834
2fde 385Gag-Pol polyprotein 3.4.23.16 0.825
3oxx DR7Gag-Pol polyprotein 3.4.23.16 0.825
3sa4 F72Protease / 0.821
3ekp 478Gag-Pol polyprotein 3.4.23.16 0.819
1mrw K57Gag-Pol polyprotein 3.4.23.16 0.809
2qhz MZ2Gag-Pol polyprotein / 0.807
3sa6 F71Protease / 0.787
3el1 DR7Gag-Pol polyprotein 3.4.23.16 0.770
3em4 DR7Gag-Pol polyprotein 3.4.23.16 0.769
1ffi 2NCGag-Pol polyprotein 3.4.23.16 0.766
1yt9 OISGag-Pol polyprotein / 0.766
3sm2 478Putative gag-pro-pol polyprotein / 0.766
2psv MUVProtease / 0.761
3kfs 3TLGag-Pol polyprotein / 0.761
3a2o KNJGag-Pol polyprotein 3.4.23.16 0.760
3nls 016Gag-Pol polyprotein 3.4.23.16 0.753
1bdr IM1Gag-Pol polyprotein 3.4.23.16 0.752
1pro A88Gag-Pol polyprotein / 0.751
3el4 ROCGag-Pol polyprotein 3.4.23.16 0.751
2pk6 O33V-1 protease / 0.750
1m0b 0ZQGag-Pol polyprotein 3.4.23.16 0.749
1mrx K57Gag-Pol polyprotein 3.4.23.16 0.749
3kdb 006Gag-Pol polyprotein 3.4.23.16 0.749
1sdt MK1Gag-Pol polyprotein 3.4.23.16 0.745
3el9 DR7Gag-Pol polyprotein 3.4.23.16 0.745
2cem 2AHPol protein / 0.744
2wkz 5AHGag-Pol polyprotein / 0.744
3bva 2NCGag-Pol polyprotein 3.4.23.16 0.744
2fxe DR7Gag-Pol polyprotein 3.4.23.16 0.743
3tl9 ROCGag-Pol polyprotein 3.4.23.16 0.742
2p3c 3TLProtease / 0.741
2f3k RO1Protease / 0.739
3k4v ROCGag-Pol polyprotein 3.4.23.16 0.735
1t7j 478Gag-Pol polyprotein 3.4.23.16 0.734
2hc0 AB2Protease / 0.734
2q54 MU1Protease / 0.731
3d1y ROCGag-Pol polyprotein 3.4.23.16 0.730
3pwr ROCGag-Pol polyprotein 3.4.23.16 0.730
1ohr 1UNV-1 PROTEASE protein / 0.729
2q63 1UNGag-Pol polyprotein 3.4.23.16 0.729
3nwq 2NCGag-Pol polyprotein 3.4.23.16 0.729
2aqu DR7Gag-Pol polyprotein 3.4.23.16 0.726
3kf0 3TLGag-Pol polyprotein / 0.726
2wl0 5AHGag-Pol polyprotein / 0.724
3ekx 1UNGag-Pol polyprotein 3.4.23.16 0.723
2pyn 1UNGag-Pol polyprotein 3.4.23.16 0.722
1hpv 478Gag-Pol polyprotein / 0.718
2a1e IPFGag-Pol polyprotein 3.4.23.16 0.718
3ekw DR7Gag-Pol polyprotein 3.4.23.16 0.717
1w5v BE3Gag-Pol polyprotein 3.4.23.16 0.716
3s56 ROCProtease / 0.716
1hvr XK2Gag-Pol polyprotein / 0.715
1fg6 2NCGag-Pol polyprotein 3.4.23.16 0.714
1zsf 0ZSGag-Pol polyprotein 3.4.23.16 0.713
2pym 1UNGag-Pol polyprotein 3.4.23.16 0.713
1ec0 BEDGag-Pol polyprotein 3.4.23.16 0.710
1k2b 0Q4Gag-Pol polyprotein 3.4.23.16 0.710
1zsr 0ZTGag-Pol polyprotein 3.4.23.16 0.710
3kfr 3TLGag-Pol polyprotein / 0.709
1ebz BECGag-Pol polyprotein 3.4.23.16 0.706
1fgc 2NCGag-Pol polyprotein 3.4.23.16 0.706
3toh 079Gag-Pol polyprotein 2.7.7.49 0.706
1k6t XN1Gag-Pol polyprotein 3.4.23.16 0.705
3nyg 2NCGag-Pol polyprotein 3.4.23.16 0.705
1ajv NMBGag-Pol polyprotein 3.4.23.16 0.703
1met DMPGag-Pol polyprotein 3.4.23.16 0.703
2fle AIProtease / 0.703
3slz 3TLPutative gag-pro-pol polyprotein / 0.702
3ufn ROCGag-Pol polyprotein / 0.702
4qgi ROCGag-Pol polyprotein 3.4.23.16 0.700
1a8g 2Z4Gag-Pol polyprotein 3.4.23.16 0.699
3bxr DRRGag-Pol polyprotein 3.4.23.16 0.699
1sdv MK1Gag-Pol polyprotein 3.4.23.16 0.698
2p3a 3TLPol protein / 0.698
2q5k AB1Protease / 0.698
1mes DMPGag-Pol polyprotein 3.4.23.16 0.697
1w5x BE5Gag-Pol polyprotein 3.4.23.16 0.696
3nwx KVSGag-Pol polyprotein 3.4.23.16 0.696
1k2c 0Q4Gag-Pol polyprotein 3.4.23.16 0.695
1msm JE2Gag-Pol polyprotein 3.4.23.16 0.693
1d4j MSCGag-Pol polyprotein 3.4.23.16 0.692
1siv PSIGag-Pol polyprotein / 0.691
1hpx KNIGag-Pol polyprotein / 0.690
1b6l PI4Gag-Pol polyprotein 3.4.23.16 0.689
3i2l 2NCProtease / 0.687
2bb9 AKCGag-Pol polyprotein 3.4.23.16 0.686
3d1x ROCGag-Pol polyprotein 3.4.23.16 0.686
1d4i BEGGag-Pol polyprotein 3.4.23.16 0.685
2p3d 3TLProtease / 0.685
2pqz G0GGag-Pol polyprotein 3.4.23.16 0.685
1mui AB1Protease / 0.684
1qbs DMPGag-Pol polyprotein 3.4.23.16 0.684
1a94 0Q4Gag-Pol polyprotein 3.4.23.16 0.683
1hvi A77Protease / 0.682
1npa 3NHGag-Pol polyprotein 3.4.23.16 0.682
1npw LGZGag-Pol polyprotein 3.4.23.16 0.682
3nxe 2NCProtease / 0.682
3kfn 3TLGag-Pol polyprotein / 0.680
1k1u 0Q4Gag-Pol polyprotein 3.4.23.16 0.679
3dcr KVSProtease / 0.679
2nmy ROCProtease / 0.678
1eby BEBGag-Pol polyprotein 3.4.23.16 0.677
2b60 RITPol polyprotein / 0.676
1fg8 0Q4Gag-Pol polyprotein 3.4.23.16 0.675
3el0 1UNGag-Pol polyprotein 3.4.23.16 0.674
1ida 0POGag-Pol polyprotein 3.4.23.47 0.673
1daz 0Q4Gag-Pol polyprotein 3.4.23.16 0.671
1hxb ROCGag-Pol polyprotein 3.4.23.16 0.671
1iiq 0ZRGag-Pol polyprotein 3.4.23.16 0.671
1qbt 146Gag-Pol polyprotein 3.4.23.16 0.671
2uy0 HV1Gag-Pol polyprotein 3.4.23.16 0.670
1hsg MK1Gag-Pol polyprotein / 0.669
1izh Q50Protease / 0.669
3hzc 2NCProtease / 0.669
1hih C20Gag-Pol polyprotein / 0.668
1tcx IM1Gag-Pol polyprotein 3.4.23.16 0.668
3bgb LJGGag-Pol polyprotein 3.4.23.16 0.667
1fff 0Q4Gag-Pol polyprotein 3.4.23.16 0.666
1fej 2NCGag-Pol polyprotein 3.4.23.16 0.663
1mer DMQGag-Pol polyprotein 3.4.23.16 0.663
2aoe 0Q4Gag-Pol polyprotein 3.4.23.16 0.663
2avs MK1Gag-Pol polyprotein 3.4.23.16 0.663
2pk5 075Protease / 0.661
2qhc AB1Protease / 0.661
3ekq ROCGag-Pol polyprotein 3.4.23.16 0.661
3ndu ROCGag-Pol polyprotein 3.4.23.16 0.661
3cyx ROCGag-Pol polyprotein 3.4.23.16 0.660
1ff0 2NCGag-Pol polyprotein 3.4.23.16 0.658
1msn JE2Gag-Pol polyprotein 3.4.23.16 0.657
1w5y BE6Gag-Pol polyprotein 3.4.23.16 0.656
2pwc G3GGag-Pol polyprotein 3.4.23.16 0.656
3kdd JZQGag-Pol polyprotein 3.4.23.16 0.656
3tof 076Gag-Pol polyprotein 2.7.7.49 0.656
3gga GGWGag-Pol polyprotein / 0.655
2qi1 MZ4Gag-Pol polyprotein / 0.654
2r3t G4GGag-Pol polyprotein 3.4.23.16 0.654
2r38 G4GGag-Pol polyprotein 3.4.23.16 0.653
1hos PHPGag-Pol polyprotein / 0.652
1npv L27Gag-Pol polyprotein 3.4.23.16 0.652
2cen 4AHProtease / 0.651
2nnp ROCProtease / 0.651