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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
3pwm 017 Gag-Pol polyprotein 3.4.23.16

Complex with similar interaction patterns:

PDB ID HET Uniprot Name EC Number Binding Mode
Similarity
Align
3pwm 017Gag-Pol polyprotein 3.4.23.16 1.407
3st5 G89Gag-Pol polyprotein 3.4.23.16 1.254
2qci 065Gag-Pol polyprotein 3.4.23.16 1.249
4heg G52Gag-Pol polyprotein 3.4.23.16 1.232
3ok9 G52Gag-Pol polyprotein 3.4.23.16 1.221
3d20 017Gag-Pol polyprotein 3.4.23.16 1.220
2f80 017Gag-Pol polyprotein 3.4.23.16 1.218
3oy4 017Gag-Pol polyprotein 3.4.23.16 1.212
2z4o 065Gag-Pol polyprotein 3.4.23.16 1.210
4dqf 017Gag-Pol polyprotein / 1.206
2f81 017Gag-Pol polyprotein 3.4.23.16 1.202
4dfg 0JVGag-Pol polyprotein 3.4.23.16 1.199
4dqc 017Gag-Pol polyprotein / 1.197
3o9b K2APol polyprotein / 1.193
3o9a K14Pol polyprotein / 1.192
4njs G08Protease / 1.189
3lzv 017Gag-Pol polyprotein 3.4.23.16 1.188
3qaa G04Gag-Pol polyprotein 3.4.23.16 1.186
3r4b 74TGag-Pol polyprotein / 1.183
2hb3 GRLProtease / 1.179
3o9h K2EGag-Pol polyprotein / 1.175
4dqh 017Gag-Pol polyprotein / 1.173
4kb9 G79Protease / 1.168
3vfa 031Gag-Pol polyprotein 3.4.23.16 1.166
4dqe 017Gag-Pol polyprotein / 1.164
1t3r 017Gag-Pol polyprotein 3.4.23.16 1.163
3ecg 065Gag-Pol polyprotein 3.4.23.47 1.158
4dqb 017Gag-Pol polyprotein / 1.154
3o9c K20Pol polyprotein / 1.153
2idw 017Protease / 1.151
2ien 017Gag-Pol polyprotein 3.4.23.16 1.149
2qd8 065Gag-Pol polyprotein 3.4.23.16 1.149
4q1w 017Gag-Pol polyprotein 3.4.23.16 1.146
3lzs 017Gag-Pol polyprotein 3.4.23.16 1.143
3oxw 017Gag-Pol polyprotein 3.4.23.16 1.140
3mws 017Pol protein / 1.135
2qd6 065Gag-Pol polyprotein 3.4.23.16 1.131
2qd7 065Gag-Pol polyprotein 3.4.23.16 1.131
3em6 017Gag-Pol polyprotein 3.4.23.16 1.131
3jvy 017Gag-Pol polyprotein 3.4.23.16 1.130
3o99 K13Pol polyprotein / 1.130
3o9e A60Pol polyprotein / 1.130
3o9d K19Pol polyprotein / 1.128
4q1y 017Gag-Pol polyprotein 3.4.23.16 1.128
3lzu 017Gag-Pol polyprotein 3.4.23.16 1.126
2ieo 017Protease / 1.122
3vf5 031Gag-Pol polyprotein 3.4.23.16 1.122
3dk1 G05Gag-Pol polyprotein 3.4.23.16 1.117
2i4u DJRProtease / 1.115
4hdp G52Gag-Pol polyprotein 3.4.23.16 1.115
3ucb 017Gag-Pol polyprotein / 1.112
3vf7 031Gag-Pol polyprotein 3.4.23.16 1.112
3o9f K2DGag-Pol polyprotein / 1.108
4hdf G52Gag-Pol polyprotein 3.4.23.16 1.098
2hs1 017Protease / 1.090
4i8z G08Gag-Pol polyprotein 3.4.23.16 1.087
3cyw 017Gag-Pol polyprotein 3.4.23.16 1.086
1t7i 017Gag-Pol polyprotein 3.4.23.16 1.077
3d1z 017Gag-Pol polyprotein 3.4.23.16 1.068
3ekv 478Gag-Pol polyprotein 3.4.23.16 1.063
3i6o GR6Gag-Pol polyprotein 3.4.23.16 1.061
3s54 017Protease / 1.061
3t3c 017Gag-Pol polyprotein 3.4.23.16 1.052
3sa8 K83Protease / 1.051
3o9i A61Gag-Pol polyprotein / 1.050
4hdb G52Gag-Pol polyprotein 3.4.23.16 1.044
4njt 017Protease / 1.043
2i4x KGQProtease / 1.042
2i4d QFIProtease / 1.041
3djk G55Gag-Pol polyprotein 3.4.23.16 1.041
2fdd 385Pol protein / 1.040
2i4v DJRV-1 protease / 1.036
3jw2 017Gag-Pol polyprotein 3.4.23.16 1.035
2hs2 017Protease / 1.030
3nu6 478Gag-Pol polyprotein 3.4.23.16 1.024
4djo MK5Pol polyprotein / 1.018
4q1x 017Gag-Pol polyprotein 3.4.23.16 1.010
2qi0 MZ3Gag-Pol polyprotein / 1.008
3sab F78Protease / 1.000
1z1r HBHGag-Pol polyprotein 3.4.23.16 0.997
4ye3 G04Gag-Pol polyprotein 3.4.23.16 0.990
3nu3 478Gag-Pol polyprotein 3.4.23.16 0.989
3gi4 K60Gag-Pol polyprotein / 0.985
3mxd K53Gag-Pol polyprotein 3.4.23.16 0.982
3sa9 A68Protease / 0.981
2f8g 017Gag-Pol polyprotein 3.4.23.16 0.980
3vfb 031Gag-Pol polyprotein 3.4.23.16 0.979
3mxe K54Gag-Pol polyprotein 3.4.23.16 0.977
4djp M73Pol polyprotein / 0.974
3em3 478Gag-Pol polyprotein 3.4.23.16 0.973
2qhy MZ1Gag-Pol polyprotein / 0.971
4hla 017Gag-Pol polyprotein 3.4.23.16 0.969
2psu MUUProtease / 0.965
2i0a MUIProtease / 0.963
3nu9 478Gag-Pol polyprotein 3.4.23.16 0.963
3sac AF8Protease / 0.960
3nu4 478Gag-Pol polyprotein 3.4.23.16 0.959
3ggu 017Gag-Pol polyprotein 3.4.23.16 0.958
2qi6 MZ8Gag-Pol polyprotein / 0.957
3oxv 478Gag-Pol polyprotein 3.4.23.16 0.956
3nuo 478Gag-Pol polyprotein 3.4.23.16 0.954
4djq M86Pol polyprotein / 0.954
2qi4 MZ6Gag-Pol polyprotein / 0.953
3ekt 017Gag-Pol polyprotein 3.4.23.16 0.951
3nu5 478Gag-Pol polyprotein 3.4.23.16 0.948
3saa 77FProtease / 0.948
4djr 0KJPol polyprotein / 0.947
4j54 G52Gag-Pol polyprotein 3.4.23.16 0.934
3sa7 55AProtease / 0.930
3sa4 F72Protease / 0.928
4j55 031Gag-Pol polyprotein 3.4.23.16 0.926
1z1h HBBGag-Pol polyprotein 3.4.23.16 0.924
2qi7 MZ9Gag-Pol polyprotein / 0.923
3sa5 A69Protease / 0.923
1hpv 478Gag-Pol polyprotein / 0.922
3nuj 478Gag-Pol polyprotein 3.4.23.16 0.921
3gi6 D78Gag-Pol polyprotein / 0.919
2qi5 MZ7Gag-Pol polyprotein / 0.917
3sa6 F71Protease / 0.915
4rvj 478Protease / 0.915
4j5j 478Gag-Pol polyprotein 3.4.23.16 0.900
3sa3 23XProtease / 0.897
1d4l PI9Gag-Pol polyprotein 3.4.23.16 0.894
2qi3 MZ5Gag-Pol polyprotein / 0.894
3sm2 478Putative gag-pro-pol polyprotein / 0.890
2qhz MZ2Gag-Pol polyprotein / 0.886
2fde 385Gag-Pol polyprotein 3.4.23.16 0.883
3gi5 K62Gag-Pol polyprotein / 0.882
2i0d MUTProtease / 0.867
3s43 478Protease / 0.866
2fxe DR7Gag-Pol polyprotein 3.4.23.16 0.854
3i7e DJRGag-Pol polyprotein / 0.848
2psv MUVProtease / 0.846
3em4 DR7Gag-Pol polyprotein 3.4.23.16 0.843
1b6l PI4Gag-Pol polyprotein 3.4.23.16 0.821
2p3b 3TLV-1 PROTEASE protein / 0.816
2p3b 3TLV-1 protease / 0.816
1npv L27Gag-Pol polyprotein 3.4.23.16 0.814
3o9g F53Gag-Pol polyprotein / 0.814
3el9 DR7Gag-Pol polyprotein 3.4.23.16 0.812
1izh Q50Protease / 0.810
2a1e IPFGag-Pol polyprotein 3.4.23.16 0.807
3el4 ROCGag-Pol polyprotein 3.4.23.16 0.806
1pro A88Gag-Pol polyprotein / 0.802
1fej 2NCGag-Pol polyprotein 3.4.23.16 0.800
3ec0 GRLGag-Pol polyprotein 3.4.23.47 0.799
2nmy ROCProtease / 0.798
1yt9 OISGag-Pol polyprotein / 0.797
2hc0 AB2Protease / 0.794
2aqu DR7Gag-Pol polyprotein 3.4.23.16 0.792
3k4v ROCGag-Pol polyprotein 3.4.23.16 0.790
3s85 LK0Gag-Pol polyprotein / 0.790
3tl9 ROCGag-Pol polyprotein 3.4.23.16 0.787
3kfs 3TLGag-Pol polyprotein / 0.786
1iiq 0ZRGag-Pol polyprotein 3.4.23.16 0.780
3oxx DR7Gag-Pol polyprotein 3.4.23.16 0.777
2pk5 075Protease / 0.776
2nnp ROCProtease / 0.772
2p3a 3TLPol protein / 0.771
1b6k PI5Gag-Pol polyprotein 3.4.23.16 0.769
2bb9 AKCGag-Pol polyprotein 3.4.23.16 0.766
2fle AIProtease / 0.766
2q63 1UNGag-Pol polyprotein 3.4.23.16 0.764
3s56 ROCProtease / 0.764
1mrw K57Gag-Pol polyprotein 3.4.23.16 0.763
3d1y ROCGag-Pol polyprotein 3.4.23.16 0.763
1hih C20Gag-Pol polyprotein / 0.762
2qak 1UNGag-Pol polyprotein 3.4.23.16 0.760
1hvi A77Protease / 0.759
1siv PSIGag-Pol polyprotein / 0.759
3bvb 017Gag-Pol polyprotein 3.4.23.16 0.757
1d4i BEGGag-Pol polyprotein 3.4.23.16 0.755
1sdt MK1Gag-Pol polyprotein 3.4.23.16 0.754
3hzc 2NCProtease / 0.753
1ida 0POGag-Pol polyprotein 3.4.23.47 0.750
3kfn 3TLGag-Pol polyprotein / 0.749
4qgi ROCGag-Pol polyprotein 3.4.23.16 0.748
1b6m PI6Gag-Pol polyprotein 3.4.23.16 0.747
1k6t XN1Gag-Pol polyprotein 3.4.23.16 0.747
1hvr XK2Gag-Pol polyprotein / 0.746
2pym 1UNGag-Pol polyprotein 3.4.23.16 0.745
3kfr 3TLGag-Pol polyprotein / 0.743
2f3k RO1Protease / 0.742
2i4w KGQProtease / 0.740
3el0 1UNGag-Pol polyprotein 3.4.23.16 0.740
1fgc 2NCGag-Pol polyprotein 3.4.23.16 0.738
3el1 DR7Gag-Pol polyprotein 3.4.23.16 0.737
3cyx ROCGag-Pol polyprotein 3.4.23.16 0.736
3slz 3TLPutative gag-pro-pol polyprotein / 0.736
3eky DR7Gag-Pol polyprotein 3.4.23.16 0.735
3qp0 NI8Gag-Pol polyprotein 3.4.23.16 0.733
3pwr ROCGag-Pol polyprotein 3.4.23.16 0.731
1hiv 1ZKGag-Pol polyprotein / 0.728
3nyg 2NCGag-Pol polyprotein 3.4.23.16 0.727
4fe6 0TQGag-Pol polyprotein 3.4.23.16 0.726
2bpw 1INGag-Pol polyprotein 3.4.23.16 0.725
1npa 3NHGag-Pol polyprotein 3.4.23.16 0.724
1npw LGZGag-Pol polyprotein 3.4.23.16 0.724
3ufn ROCGag-Pol polyprotein / 0.724
1tcx IM1Gag-Pol polyprotein 3.4.23.16 0.723
1m0b 0ZQGag-Pol polyprotein 3.4.23.16 0.720
2avs MK1Gag-Pol polyprotein 3.4.23.16 0.719
2pwc G3GGag-Pol polyprotein 3.4.23.16 0.718
3i2l 2NCProtease / 0.717
3ndu ROCGag-Pol polyprotein 3.4.23.16 0.716
1bdr IM1Gag-Pol polyprotein 3.4.23.16 0.714
1odx 0E8Gag-Pol polyprotein 3.4.23.16 0.713
3bxr DRRGag-Pol polyprotein 3.4.23.16 0.713
1ebz BECGag-Pol polyprotein 3.4.23.16 0.712
3ggx GGXGag-Pol polyprotein / 0.712
1bwb 146Gag-Pol polyprotein 3.4.23.16 0.709
2p3d 3TLProtease / 0.709
3d1x ROCGag-Pol polyprotein 3.4.23.16 0.709
2nnk ROCProtease / 0.708
1daz 0Q4Gag-Pol polyprotein 3.4.23.16 0.707
1qbt 146Gag-Pol polyprotein 3.4.23.16 0.707
1fg8 0Q4Gag-Pol polyprotein 3.4.23.16 0.706
3nwq 2NCGag-Pol polyprotein 3.4.23.16 0.706
1a94 0Q4Gag-Pol polyprotein 3.4.23.16 0.704
1hii C20Gag-Pol polyprotein / 0.704
3dck KVIProtease / 0.704
1sdv MK1Gag-Pol polyprotein 3.4.23.16 0.703
2avv MK1Gag-Pol polyprotein 3.4.23.16 0.703
1d4h BEHGag-Pol polyprotein 3.4.23.16 0.702
1ivq 0PXGag-Pol polyprotein / 0.701
1jld 0PPGag-Pol polyprotein / 0.701
3dcr KVSProtease / 0.700
1sbg IM1Gag-Pol polyprotein / 0.699
2cem 2AHPol protein / 0.697
2q64 1UNGag-Pol polyprotein 3.4.23.16 0.696
2uy0 HV1Gag-Pol polyprotein 3.4.23.16 0.696
3ekq ROCGag-Pol polyprotein 3.4.23.16 0.695
1a8g 2Z4Gag-Pol polyprotein 3.4.23.16 0.694
3gga GGWGag-Pol polyprotein / 0.694
3so9 017Pol protein / 0.693
1fff 0Q4Gag-Pol polyprotein 3.4.23.16 0.692
1mer DMQGag-Pol polyprotein 3.4.23.16 0.692
3dm6 757Beta-secretase 1 3.4.23.46 0.690
1ec3 MS3Gag-Pol polyprotein 3.4.23.16 0.689
2aoe 0Q4Gag-Pol polyprotein 3.4.23.16 0.689
1izi Q50Gag-Pol polyprotein 3.4.23.16 0.688
3ekp 478Gag-Pol polyprotein 3.4.23.16 0.688
3ndt ROCGag-Pol polyprotein 3.4.23.16 0.688
3ttp 017Gag-Pol polyprotein 3.4.23.16 0.688
1k2c 0Q4Gag-Pol polyprotein 3.4.23.16 0.687
2rkf AB1Pol protein / 0.685
1mrx K57Gag-Pol polyprotein 3.4.23.16 0.684
1idb 0DOGag-Pol polyprotein / 0.683
2avm 2NCGag-Pol polyprotein 3.4.23.16 0.683
1ec1 BEEGag-Pol polyprotein 3.4.23.16 0.682
1meu DMPGag-Pol polyprotein 3.4.23.16 0.680
1ohr 1UNV-1 PROTEASE protein / 0.680
3kf0 3TLGag-Pol polyprotein / 0.680
1hvj A78Gag-Pol polyprotein / 0.679
2wkz 5AHGag-Pol polyprotein / 0.678
3toh 079Gag-Pol polyprotein 2.7.7.49 0.677
1hvk A79Gag-Pol polyprotein / 0.676
1sdu MK1Gag-Pol polyprotein 3.4.23.16 0.676
3bxs DRSGag-Pol polyprotein 3.4.23.16 0.673
3kdc JZPGag-Pol polyprotein 3.4.23.16 0.673
3tog 079Gag-Pol polyprotein 2.7.7.49 0.673
2q55 MU0Protease / 0.670
3qn8 NI7Gag-Pol polyprotein 3.4.23.16 0.668
1dw6 0Q4Gag-Pol polyprotein 3.4.23.16 0.667
1eby BEBGag-Pol polyprotein 3.4.23.16 0.667
1mtr PI6Gag-Pol polyprotein 3.4.23.16 0.667
1c6y MK1Protease / 0.666
1ebw BEIGag-Pol polyprotein 3.4.23.16 0.665
4ca7 3EFAngiotensin-converting enzyme 3.4.15.1 0.664
1rl8 RITGag-Pol polyprotein 3.4.23.16 0.661
1b6p PI7Gag-Pol polyprotein 3.4.23.16 0.660
3jvw DMPGag-Pol polyprotein 3.4.23.16 0.659
1zsr 0ZTGag-Pol polyprotein 3.4.23.16 0.656
1wbm BLLPol protein / 0.655
3ekw DR7Gag-Pol polyprotein 3.4.23.16 0.655
1ec2 BEJGag-Pol polyprotein 3.4.23.16 0.654
1ffi 2NCGag-Pol polyprotein 3.4.23.16 0.654
1hxw RITGag-Pol polyprotein / 0.654
1w5v BE3Gag-Pol polyprotein 3.4.23.16 0.651
1qbr XV6Gag-Pol polyprotein 3.4.23.16 0.650
2pwr G4GGag-Pol polyprotein 3.4.23.16 0.650