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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
2a1e IPF Gag-Pol polyprotein 3.4.23.16

Complex with similar interaction patterns:

PDB ID HET Uniprot Name EC Number Binding Mode
Similarity
Align
2a1e IPFGag-Pol polyprotein 3.4.23.16 1.669
3eky DR7Gag-Pol polyprotein 3.4.23.16 0.960
3kfr 3TLGag-Pol polyprotein / 0.921
1vik BAYGag-Pol polyprotein / 0.919
1hvk A79Gag-Pol polyprotein / 0.899
2aqu DR7Gag-Pol polyprotein 3.4.23.16 0.899
2p3d 3TLProtease / 0.897
3el1 DR7Gag-Pol polyprotein 3.4.23.16 0.897
3fx5 KNIGag-Pol polyprotein 3.4.23.16 0.892
1ffi 2NCGag-Pol polyprotein 3.4.23.16 0.887
3kfs 3TLGag-Pol polyprotein / 0.881
1hpx KNIGag-Pol polyprotein / 0.875
1daz 0Q4Gag-Pol polyprotein 3.4.23.16 0.863
4k4p 3TLGag-Pol polyprotein / 0.861
3nwx KVSGag-Pol polyprotein 3.4.23.16 0.859
2pk5 075Protease / 0.856
3kf0 3TLGag-Pol polyprotein / 0.853
3em4 DR7Gag-Pol polyprotein 3.4.23.16 0.850
3i2l 2NCProtease / 0.848
3bxr DRRGag-Pol polyprotein 3.4.23.16 0.834
2avm 2NCGag-Pol polyprotein 3.4.23.16 0.829
2p3c 3TLProtease / 0.829
1fgc 2NCGag-Pol polyprotein 3.4.23.16 0.828
3tog 079Gag-Pol polyprotein 2.7.7.49 0.827
1ody LP1Gag-Pol polyprotein 3.4.23.16 0.825
3ekw DR7Gag-Pol polyprotein 3.4.23.16 0.825
3nxe 2NCProtease / 0.825
3dck KVIProtease / 0.824
1fff 0Q4Gag-Pol polyprotein 3.4.23.16 0.821
4kb9 G79Protease / 0.820
2fxe DR7Gag-Pol polyprotein 3.4.23.16 0.819
3sa9 A68Protease / 0.819
3gga GGWGag-Pol polyprotein / 0.818
3el9 DR7Gag-Pol polyprotein 3.4.23.16 0.817
1hih C20Gag-Pol polyprotein / 0.816
1ff0 2NCGag-Pol polyprotein 3.4.23.16 0.815
2pk6 O33V-1 protease / 0.815
1z1h HBBGag-Pol polyprotein 3.4.23.16 0.812
2aoe 0Q4Gag-Pol polyprotein 3.4.23.16 0.811
2fle AIProtease / 0.808
1mrx K57Gag-Pol polyprotein 3.4.23.16 0.807
2fxd DR7Pol polyprotein / 0.807
1fej 2NCGag-Pol polyprotein 3.4.23.16 0.805
2q5k AB1Protease / 0.804
3pwm 017Gag-Pol polyprotein 3.4.23.16 0.803
1k2b 0Q4Gag-Pol polyprotein 3.4.23.16 0.798
2bpv 1INGag-Pol polyprotein 3.4.23.16 0.798
3tof 076Gag-Pol polyprotein 2.7.7.49 0.798
3d1x ROCGag-Pol polyprotein 3.4.23.16 0.796
3sa7 55AProtease / 0.793
1iiq 0ZRGag-Pol polyprotein 3.4.23.16 0.791
4dfg 0JVGag-Pol polyprotein 3.4.23.16 0.789
3lin E13Protease / 0.788
3st5 G89Gag-Pol polyprotein 3.4.23.16 0.788
3oxx DR7Gag-Pol polyprotein 3.4.23.16 0.787
2wkz 5AHGag-Pol polyprotein / 0.786
2cem 2AHPol protein / 0.785
3nuj 478Gag-Pol polyprotein 3.4.23.16 0.784
4hdp G52Gag-Pol polyprotein 3.4.23.16 0.784
1mtr PI6Gag-Pol polyprotein 3.4.23.16 0.783
3sa5 A69Protease / 0.782
3el5 1UNGag-Pol polyprotein / 0.781
3nuo 478Gag-Pol polyprotein 3.4.23.16 0.781
3nu6 478Gag-Pol polyprotein 3.4.23.16 0.779
1bv7 XV6Gag-Pol polyprotein 3.4.23.16 0.778
3qaa G04Gag-Pol polyprotein 3.4.23.16 0.777
3tl9 ROCGag-Pol polyprotein 3.4.23.16 0.777
2cen 4AHProtease / 0.775
3nu3 478Gag-Pol polyprotein 3.4.23.16 0.775
3o9h K2EGag-Pol polyprotein / 0.775
3toh 079Gag-Pol polyprotein 2.7.7.49 0.775
3i6o GR6Gag-Pol polyprotein 3.4.23.16 0.774
1b6k PI5Gag-Pol polyprotein 3.4.23.16 0.773
3nu9 478Gag-Pol polyprotein 3.4.23.16 0.773
3d1y ROCGag-Pol polyprotein 3.4.23.16 0.772
1izh Q50Protease / 0.771
3ekx 1UNGag-Pol polyprotein 3.4.23.16 0.770
3hzc 2NCProtease / 0.769
2q54 MU1Protease / 0.767
3em3 478Gag-Pol polyprotein 3.4.23.16 0.767
3mws 017Pol protein / 0.766
3nu4 478Gag-Pol polyprotein 3.4.23.16 0.766
3oxv 478Gag-Pol polyprotein 3.4.23.16 0.766
1k2c 0Q4Gag-Pol polyprotein 3.4.23.16 0.765
4heg G52Gag-Pol polyprotein 3.4.23.16 0.765
1a94 0Q4Gag-Pol polyprotein 3.4.23.16 0.763
1fg8 0Q4Gag-Pol polyprotein 3.4.23.16 0.762
3dcr KVSProtease / 0.762
3kfp 3TLGag-Pol polyprotein / 0.761
1ida 0POGag-Pol polyprotein 3.4.23.47 0.760
3kfn 3TLGag-Pol polyprotein / 0.758
3s43 478Protease / 0.758
1msn JE2Gag-Pol polyprotein 3.4.23.16 0.757
1d4l PI9Gag-Pol polyprotein 3.4.23.16 0.755
2hb3 GRLProtease / 0.754
2az8 3TLGag-Pol polyprotein 3.4.23.16 0.753
2b60 RITPol polyprotein / 0.753
2p3a 3TLPol protein / 0.753
1hii C20Gag-Pol polyprotein / 0.752
3d20 017Gag-Pol polyprotein 3.4.23.16 0.752
3bvb 017Gag-Pol polyprotein 3.4.23.16 0.751
3ndw RITGag-Pol polyprotein 3.4.23.16 0.751
3nyg 2NCGag-Pol polyprotein 3.4.23.16 0.751
1hvl A76Gag-Pol polyprotein / 0.750
4j5j 478Gag-Pol polyprotein 3.4.23.16 0.750
1hvj A78Gag-Pol polyprotein / 0.749
2f81 017Gag-Pol polyprotein 3.4.23.16 0.749
2nnp ROCProtease / 0.749
3sa3 23XProtease / 0.749
3pwr ROCGag-Pol polyprotein 3.4.23.16 0.748
1vij BAYGag-Pol polyprotein / 0.747
1meu DMPGag-Pol polyprotein 3.4.23.16 0.746
2i4w KGQProtease / 0.746
3sab F78Protease / 0.746
1bwb 146Gag-Pol polyprotein 3.4.23.16 0.745
1ebz BECGag-Pol polyprotein 3.4.23.16 0.745
1fg6 2NCGag-Pol polyprotein 3.4.23.16 0.744
2qi0 MZ3Gag-Pol polyprotein / 0.744
1ec1 BEEGag-Pol polyprotein 3.4.23.16 0.741
1zsf 0ZSGag-Pol polyprotein 3.4.23.16 0.741
2f8g 017Gag-Pol polyprotein 3.4.23.16 0.741
4q1y 017Gag-Pol polyprotein 3.4.23.16 0.741
3ndx RITGag-Pol polyprotein 3.4.23.16 0.740
4njs G08Protease / 0.739
1ajv NMBGag-Pol polyprotein 3.4.23.16 0.738
1hxw RITGag-Pol polyprotein / 0.738
2i4x KGQProtease / 0.738
3oxw 017Gag-Pol polyprotein 3.4.23.16 0.738
1hxb ROCGag-Pol polyprotein 3.4.23.16 0.737
3d1z 017Gag-Pol polyprotein 3.4.23.16 0.737
2p3b 3TLV-1 PROTEASE protein / 0.736
2p3b 3TLV-1 protease / 0.736
1t7i 017Gag-Pol polyprotein 3.4.23.16 0.735
2uxz HI1Gag-Pol polyprotein 3.4.23.16 0.735
3cyx ROCGag-Pol polyprotein 3.4.23.16 0.735
1mes DMPGag-Pol polyprotein 3.4.23.16 0.734
2qd8 065Gag-Pol polyprotein 3.4.23.16 0.734
4dqb 017Gag-Pol polyprotein / 0.734
4djp M73Pol polyprotein / 0.733
1qbu 846Gag-Pol polyprotein 3.4.23.16 0.732
2hs1 017Protease / 0.730
2bbb HH1Gag-Pol polyprotein 3.4.23.16 0.728
2qi5 MZ7Gag-Pol polyprotein / 0.727
1t7k BH0Gag-Pol polyprotein 3.4.23.16 0.726
2nnk ROCProtease / 0.726
4fiv LP1POL protein / 0.725
1d4j MSCGag-Pol polyprotein 3.4.23.16 0.724
3el4 ROCGag-Pol polyprotein 3.4.23.16 0.724
4q1w 017Gag-Pol polyprotein 3.4.23.16 0.723
1b6m PI6Gag-Pol polyprotein 3.4.23.16 0.722
2ien 017Gag-Pol polyprotein 3.4.23.16 0.722
3vf7 031Gag-Pol polyprotein 3.4.23.16 0.722
3vfa 031Gag-Pol polyprotein 3.4.23.16 0.722
3gi6 D78Gag-Pol polyprotein / 0.721
4dqe 017Gag-Pol polyprotein / 0.721
9hvp 0E9Gag-Pol polyprotein / 0.721
1dw6 0Q4Gag-Pol polyprotein 3.4.23.16 0.720
2qci 065Gag-Pol polyprotein 3.4.23.16 0.720
2rkf AB1Pol protein / 0.720
1zsr 0ZTGag-Pol polyprotein 3.4.23.16 0.719
2bpw 1INGag-Pol polyprotein 3.4.23.16 0.719
3o9f K2DGag-Pol polyprotein / 0.719
2qd6 065Gag-Pol polyprotein 3.4.23.16 0.718
3bva 2NCGag-Pol polyprotein 3.4.23.16 0.718
3o9a K14Pol polyprotein / 0.718
4ye3 G04Gag-Pol polyprotein 3.4.23.16 0.718
3ec0 GRLGag-Pol polyprotein 3.4.23.47 0.717
3liq E14Protease / 0.717
3liv E16Protease / 0.717
3lit E15Protease / 0.716
3o9c K20Pol polyprotein / 0.716
2idw 017Protease / 0.715
2rkg AB1Pol protein / 0.715
3vf5 031Gag-Pol polyprotein 3.4.23.16 0.715
1b11 3TLPol polyprotein / 0.710
1hos PHPGag-Pol polyprotein / 0.710
2xyf G40Gag-Pol polyprotein / 0.710
3jw2 017Gag-Pol polyprotein 3.4.23.16 0.710
3lzu 017Gag-Pol polyprotein 3.4.23.16 0.710
1met DMPGag-Pol polyprotein 3.4.23.16 0.708
3s54 017Protease / 0.707
2f80 017Gag-Pol polyprotein 3.4.23.16 0.705
3ndu ROCGag-Pol polyprotein 3.4.23.16 0.705
3o9d K19Pol polyprotein / 0.705
4dqh 017Gag-Pol polyprotein / 0.705
1qbr XV6Gag-Pol polyprotein 3.4.23.16 0.704
4hdb G52Gag-Pol polyprotein 3.4.23.16 0.704
4j54 G52Gag-Pol polyprotein 3.4.23.16 0.704
3lzv 017Gag-Pol polyprotein 3.4.23.16 0.703
3sa8 K83Protease / 0.703
3t3c 017Gag-Pol polyprotein 3.4.23.16 0.703
1ec3 MS3Gag-Pol polyprotein 3.4.23.16 0.702
2z4o 065Gag-Pol polyprotein 3.4.23.16 0.702
3ekp 478Gag-Pol polyprotein 3.4.23.16 0.699
3tlh 3TLGag-Pol polyprotein 3.4.23.16 0.699
3nls 016Gag-Pol polyprotein 3.4.23.16 0.698
4nju TPVProtease / 0.698
1dmp DMQGag-Pol polyprotein 3.4.23.16 0.697
3qp0 NI8Gag-Pol polyprotein 3.4.23.16 0.696
3ucb 017Gag-Pol polyprotein / 0.696
1c6z ROCProtease / 0.695
4q1x 017Gag-Pol polyprotein 3.4.23.16 0.695
2r5q 1UNGag-Pol polyprotein / 0.694
2pym 1UNGag-Pol polyprotein 3.4.23.16 0.693
3o9i A61Gag-Pol polyprotein / 0.693
1ebk 0Q4Gag-Pol polyprotein 3.4.23.16 0.692
1hsg MK1Gag-Pol polyprotein / 0.692
2bpy 3INGag-Pol polyprotein 3.4.23.16 0.692
4i8z G08Gag-Pol polyprotein 3.4.23.16 0.692
1g2k NM1Gag-Pol polyprotein 3.4.23.16 0.691
3ekt 017Gag-Pol polyprotein 3.4.23.16 0.691
4djo MK5Pol polyprotein / 0.691
3o9g F53Gag-Pol polyprotein / 0.690
3slz 3TLPutative gag-pro-pol polyprotein / 0.690
3ecg 065Gag-Pol polyprotein 3.4.23.47 0.689
3nwq 2NCGag-Pol polyprotein 3.4.23.16 0.689
3oy4 017Gag-Pol polyprotein 3.4.23.16 0.689
4rvj 478Protease / 0.689
1mer DMQGag-Pol polyprotein 3.4.23.16 0.686
2qi3 MZ5Gag-Pol polyprotein / 0.686
3o99 K13Pol polyprotein / 0.686
3oxc ROCProtease / 0.686
4a4q UX9Pol protein / 0.685
2pwc G3GGag-Pol polyprotein 3.4.23.16 0.684
2qd7 065Gag-Pol polyprotein 3.4.23.16 0.684
3ekv 478Gag-Pol polyprotein 3.4.23.16 0.684
1rl8 RITGag-Pol polyprotein 3.4.23.16 0.683
2hah 3TLPOL protein / 0.683
1hvi A77Protease / 0.682
1jld 0PPGag-Pol polyprotein / 0.681
2q63 1UNGag-Pol polyprotein 3.4.23.16 0.680
3djk G55Gag-Pol polyprotein 3.4.23.16 0.680
1t3r 017Gag-Pol polyprotein 3.4.23.16 0.679
2qi4 MZ6Gag-Pol polyprotein / 0.679
3bxs DRSGag-Pol polyprotein 3.4.23.16 0.679
3ggu 017Gag-Pol polyprotein 3.4.23.16 0.679
3ggx GGXGag-Pol polyprotein / 0.679
3gi4 K60Gag-Pol polyprotein / 0.679
1ivp 1ZKGag-Pol polyprotein / 0.678
1msm JE2Gag-Pol polyprotein 3.4.23.16 0.678
4dqc 017Gag-Pol polyprotein / 0.678
3kdb 006Gag-Pol polyprotein 3.4.23.16 0.677
4njt 017Protease / 0.677
1bwa XV6Gag-Pol polyprotein 3.4.23.16 0.675
1odx 0E8Gag-Pol polyprotein 3.4.23.16 0.674
2azb 3TLGag-Pol polyprotein 3.4.23.16 0.673
3jvy 017Gag-Pol polyprotein 3.4.23.16 0.673
3kdc JZPGag-Pol polyprotein 3.4.23.16 0.672
3r4b 74TGag-Pol polyprotein / 0.672
3o9b K2APol polyprotein / 0.671
1t7j 478Gag-Pol polyprotein 3.4.23.16 0.670
3lix E17Protease / 0.670
1ebw BEIGag-Pol polyprotein 3.4.23.16 0.669
2q55 MU0Protease / 0.669
3s56 ROCProtease / 0.669
1n49 RITGag-Pol polyprotein 3.4.23.16 0.668
2r38 G4GGag-Pol polyprotein 3.4.23.16 0.668
1a8g 2Z4Gag-Pol polyprotein 3.4.23.16 0.667
1mrw K57Gag-Pol polyprotein 3.4.23.16 0.667
2xye CXGGag-Pol polyprotein / 0.667
1k1u 0Q4Gag-Pol polyprotein 3.4.23.16 0.666
3ekq ROCGag-Pol polyprotein 3.4.23.16 0.666
3ndt ROCGag-Pol polyprotein 3.4.23.16 0.666
4hdf G52Gag-Pol polyprotein 3.4.23.16 0.666
2bpz 3INGag-Pol polyprotein 3.4.23.16 0.665
2fmb LP1Reverse transcriptase / 0.665
3dk1 G05Gag-Pol polyprotein 3.4.23.16 0.665
4djq M86Pol polyprotein / 0.665
1k6p XN3Gag-Pol polyprotein 3.4.23.16 0.664
3ok9 G52Gag-Pol polyprotein 3.4.23.16 0.663
1ajx AH1Gag-Pol polyprotein 3.4.23.16 0.662
1kzk JE2Gag-Pol polyprotein 3.4.23.16 0.662
2pqz G0GGag-Pol polyprotein 3.4.23.16 0.661
2qnp QN2Gag-Pol polyprotein 3.4.23.16 0.661
3sac AF8Protease / 0.661
3sm2 478Putative gag-pro-pol polyprotein / 0.661
2bqv A1AProtease / 0.660
2ieo 017Protease / 0.660
2r3w G3GGag-Pol polyprotein 3.4.23.16 0.660
4njv RITProtease / 0.660
2psv MUVProtease / 0.659
2qi6 MZ8Gag-Pol polyprotein / 0.659
3ttp 017Gag-Pol polyprotein 3.4.23.16 0.659
1bdr IM1Gag-Pol polyprotein 3.4.23.16 0.658
2fdd 385Pol protein / 0.657
3bgc LJHGag-Pol polyprotein 3.4.23.16 0.657
3em6 017Gag-Pol polyprotein 3.4.23.16 0.657
3k4v ROCGag-Pol polyprotein 3.4.23.16 0.655
1ec2 BEJGag-Pol polyprotein 3.4.23.16 0.654
3qn8 NI7Gag-Pol polyprotein 3.4.23.16 0.654
1izi Q50Gag-Pol polyprotein 3.4.23.16 0.653
1sdv MK1Gag-Pol polyprotein 3.4.23.16 0.653
2hs2 017Protease / 0.653
4j55 031Gag-Pol polyprotein 3.4.23.16 0.653
2q64 1UNGag-Pol polyprotein 3.4.23.16 0.651
1b6l PI4Gag-Pol polyprotein 3.4.23.16 0.650
2i4d QFIProtease / 0.650
3kdd JZQGag-Pol polyprotein 3.4.23.16 0.650
3sa6 F71Protease / 0.650
3ufn ROCGag-Pol polyprotein / 0.650