BioXGEM.Anchor : pocket and moieties

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Target: 3ert  Query compounds: 1000  Anchor   H1:  319 compounds

Protein Strands Ribbons Cartoons Surface None anchors(on/off) Contents SiMMap (anchors) : 4  anchors Elec(E)    :   Hbond(H) :    vdW(V)    :      Compound : site-moiety map 3ert & 1000 compounds Download Binding site SiMMap (anchors) Protein-compound interaction profiles Anchor scores of query compounds

Anchor H1 Moiety type Pocket residue Energy E353 Side L387 Main R394 Side MFCD00013089 043 -20.8 -7.8 -6.0 -7.0 MFCD00011890 021 -20.6 -10.4 -6.7 -3.5 MFCD00013054 092 -17.6 -10.5 -7.0 -0.1 MFCD00012787 045 -17.5 -10.4 -7.0 -0.1 MFCD00011887 021 -16.9 -9.9 -6.9 -0.1 MFCD00011886 021 -16 -9.1 -6.8 -0.1 MFCD00011891 021 -15.7 -9.4 -6.2 -0.1 MFCD00010591 015 -14.4 -5.0 -2.4 -7.0 MFCD00011716 015 -14.1 -5.0 -2.5 -6.6 MFCD00017051 013 -14 -7.0 -3.5 -3.5 MFCD00013170 003 -14.1 -7.0 -7.0 -0.1 MFCD00011892 021 -14.1 -10.5 -3.5 -0.1 MFCD00003608 015 -13.9 -4.9 -2.5 -6.5 MFCD00003610 015 -13.8 -4.6 -2.5 -6.7 MFCD00010486 015 -13.4 -4.8 -2.5 -6.1 MFCD00003661 015 -13.3 -5.0 -2.5 -5.8 MFCD00002608 024 -13.2 -6.2 -3.5 -3.5 MFCD00005756 024 -12.5 -6.6 -5.8 -0.1 MFCD00012780 015 -12 -2.5 -2.5 -7.0 MFCD00011885 021 -12.1 -5.6 -6.4 -0.1 MFCD00005735 015 -11.6 -2.1 -2.5 -7.0 MFCD00005179 015 -10.9 -4.9 -2.5 -3.5 MFCD00004056 015 -10.6 -1.6 -2.5 -6.5 MFCD00016422 046 -10.6 -7.0 -3.5 -0.1 MFCD00013164 024 -10.6 -7.0 -3.5 -0.1 MFCD00013156 024 -10.6 -7.0 -3.5 -0.1 MFCD00012681 045 -10.6 -7.0 -3.5 -0.1 MFCD00008363 021 -10.6 -7.0 -3.5 -0.1 MFCD00003624 015 -10.6 -5.0 -0.1 -5.5 MFCD00005749 024 -10.3 -6.7 -3.5 -0.1 MFCD00020113 015 -10.1 -4.6 -2.0 -3.5 MFCD00012685 024 -10.2 -6.6 -3.5 -0.1 MFCD00006710 024 -10.2 -7.0 -3.1 -0.1 MFCD00005757 003 -10.2 -6.8 -3.3 -0.1 MFCD00012557 012 -10 -6.4 -3.5 -0.1 MFCD00013149 012 -9.6 -6.0 -3.5 -0.1 MFCD00008037 043 -9.5 -3.5 -2.5 -3.5 MFCD00003662 003 -9.6 -0.1 -2.5 -7.0 MFCD00004258 024 -9.5 -5.9 -3.5 -0.1 MFCD00013150 012 -9.5 -6.1 -3.3 -0.1 MFCD00017311 015 -9.1 -4.0 -2.0 -3.1 MFCD00017058 021 -8.8 -3.5 -2.6 -2.7 MFCD00017075 021 -8.7 -3.5 -2.3 -2.9 MFCD00006626 015 -8.5 -2.5 -2.5 -3.5 MFCD00004720 015 -8.6 -5.0 -0.1 -3.5 MFCD00004690 015 -8.5 -2.5 -2.5 -3.5 MFCD00016941 015 -8.5 -4.9 -0.1 -3.5 MFCD00013095 006 -8.3 -2.5 -2.3 -3.5 MFCD00006628 015 -8.2 -2.5 -2.5 -3.2 MFCD00004675 015 -8.1 -2.5 -2.1 -3.5 EST_06 015 -8.1 -2.5 -2.1 -3.5 MFCD00012604 018 -8 -2.0 -2.5 -3.5 MFCD00002310 015 -8 -2.0 -2.5 -3.5 MFCD00013139 018 -7.9 -2.5 -1.9 -3.5 MFCD00016926 015 -7.9 -4.3 -0.1 -3.5 MFCD00016930 015 -7.7 -4.1 -0.1 -3.5 MFCD00016749 015 -7.3 -1.7 -2.4 -3.2 MFCD00016736 040 -7.2 -0.1 -0.1 -7.0 MFCD00015937 024 -7.1 -3.5 -3.5 -0.1 MFCD00015837 082 -7.2 -0.1 -0.1 -7.0 MFCD00013974 040 -7.2 -0.1 -0.1 -7.0 MFCD00013358 075 -7.2 -0.1 -0.1 -7.0 MFCD00013093 043 -7.1 -0.1 -3.5 -3.5 MFCD00012969 092 -7.1 -3.5 -3.5 -0.1 MFCD00012967 092 -7.1 -3.5 -3.5 -0.1 MFCD00012733 092 -7.1 -3.5 -3.5 -0.1 MFCD00007681 040 -7.2 -0.1 -0.1 -7.0 MFCD00007528 075 -7.2 -0.1 -0.1 -7.0 MFCD00006546 043 -7.1 -3.5 -3.5 -0.1 MFCD00006525 043 -7.1 -3.5 -0.1 -3.5 MFCD00006159 075 -7.2 -0.1 -0.1 -7.0 MFCD00005882 057 -7.1 -3.5 -0.1 -3.5 MFCD00005750 003 -7.1 -3.5 -3.5 -0.1 MFCD00005184 092 -7.1 -3.5 -3.5 -0.1 MFCD00004288 040 -7.2 -0.1 -0.1 -7.0 MFCD00004174 040 -7.2 -0.1 -0.1 -7.0 MFCD00004079 040 -7.2 -0.1 -0.1 -7.0 MFCD00002631 024 -7.2 -0.1 -0.1 -7.0 MFCD00002420 040 -7.2 -0.1 -0.1 -7.0 MFCD00016495 040 -7.1 -0.1 -0.1 -6.9 MFCD00012914 024 -7 -3.5 -3.4 -0.1 MFCD00004208 040 -7.1 -0.1 -0.1 -6.9 MFCD00012679 015 -6.9 -0.1 -0.4 -6.4 MFCD00002768 040 -7 -0.1 -0.1 -6.8 MFCD00012699 024 -6.8 -3.2 -3.5 -0.1 MFCD00011665 063 -6.8 -3.2 -3.5 -0.1 MFCD00010410 040 -6.9 -0.1 -0.1 -6.7 MFCD00007469 075 -6.9 -0.1 -0.1 -6.7 MFCD00002811 040 -6.8 -0.1 -0.1 -6.6 MFCD00005753 003 -6.6 -3.0 -3.5 -0.1 MFCD00011508 075 -6.4 -0.1 -0.1 -6.2 MFCD00020139 015 -6.1 -0.1 -2.5 -3.5 MFCD00016933 015 -6.1 -2.5 -0.1 -3.5 MFCD00016932 015 -6.1 -2.5 -0.1 -3.5 MFCD00016931 018 -6.1 -0.1 -2.5 -3.5 MFCD00016883 015 -6.1 -0.1 -2.5 -3.5 MFCD00016778 015 -6.1 -0.1 -2.5 -3.5 MFCD00016624 015 -6.1 -0.1 -2.5 -3.5 MFCD00013140 015 -6.1 -0.1 -2.5 -3.5 MFCD00012748 015 -6.1 -2.5 -0.1 -3.5 MFCD00011927 015 -6.1 -2.5 -0.1 -3.5 MFCD00009823 015 -6.1 -2.5 -0.1 -3.5 MFCD00006598 015 -6.1 -0.1 -2.5 -3.5 MFCD00006591 015 -6.1 -0.1 -2.5 -3.5 MFCD00006532 015 -6.1 -0.1 -2.5 -3.5 MFCD00006528 015 -6.1 -0.1 -2.5 -3.5 MFCD00003870 013 -6.1 -2.5 -0.1 -3.5 MFCD00002593 015 -6.1 -0.1 -2.5 -3.5 MFCD00002206 018 -6.1 -2.5 -0.1 -3.5 EST_07 013 -6.1 -2.5 -0.1 -3.5 EST_05 013 -6.1 -2.5 -0.1 -3.5 EST_02 015 -6.1 -0.1 -2.5 -3.5 MFCD00020131 015 -6 -0.1 -2.4 -3.5 MFCD00020103 015 -6 -0.1 -2.4 -3.5 EST_08 015 -6 -2.5 -0.1 -3.4 MFCD00016362 015 -5.9 -0.1 -2.3 -3.5 MFCD00009628 015 -5.9 -0.1 -2.5 -3.3 MFCD00002180 040 -6 -0.1 -0.1 -5.8 EST_01 015 -5.9 -2.3 -0.1 -3.5 MFCD00010572 015 -5.8 -2.2 -0.1 -3.5 MFCD00005844 003 -5.8 -2.2 -3.5 -0.1 MFCD00012742 015 -5.8 -2.3 -0.1 -3.4 MFCD00002371 015 -5.6 -2.5 -0.1 -3.0 MFCD00002292 015 -5.6 -0.1 -2.5 -3.0 MFCD00012189 015 -5.4 -0.1 -2.2 -3.1 MFCD00020109 015 -5.4 -2.5 -0.1 -2.8 MFCD00005542 015 -5.3 -0.1 -2.5 -2.7 MFCD00016787 015 -5.2 -0.1 -2.5 -2.6 MFCD00005747 015 -5 -2.5 -0.1 -2.4 MFCD00006630 015 -4.8 -0.1 -2.2 -2.5 MFCD00006714 073 -4 -0.1 -0.1 -3.8 MFCD00005666 015 -3.8 0.7 -1.0 -3.5 MFCD00017174 019 -3.7 -0.1 -0.1 -3.5 MFCD00016925 019 -3.7 -0.1 -0.1 -3.5 MFCD00016532 040 -3.7 -0.1 -0.1 -3.5 MFCD00016513 040 -3.7 -0.1 -0.1 -3.5 MFCD00016511 040 -3.7 -0.1 -0.1 -3.5 MFCD00016510 040 -3.7 -0.1 -0.1 -3.5 MFCD00016489 019 -3.7 -0.1 -0.1 -3.5 MFCD00015838 082 -3.7 -0.1 -0.1 -3.5 MFCD00014730 075 -3.7 -0.1 -0.1 -3.5 MFCD00014346 040 -3.7 -0.1 -0.1 -3.5 MFCD00013786 003 -3.7 -0.1 -0.1 -3.5 MFCD00013326 025 -3.7 -0.1 -3.5 -0.1 MFCD00013223 006 -3.7 -3.5 -0.1 -0.1 MFCD00013221 043 -3.7 -0.1 -0.1 -3.5 MFCD00013161 092 -3.7 -3.5 -0.1 -0.1 MFCD00013144 025 -3.7 -3.5 -0.1 -0.1 MFCD00013129 006 -3.7 -0.1 -3.5 -0.1 MFCD00012961 024 -3.7 -0.1 -3.5 -0.1 MFCD00012823 006 -3.7 -3.5 -0.1 -0.1 MFCD00012784 092 -3.7 -3.5 -0.1 -0.1 MFCD00012732 040 -3.7 -0.1 -0.1 -3.5 MFCD00012691 003 -3.7 -3.5 -0.1 -0.1 MFCD00012569 006 -3.7 -0.1 -3.5 -0.1 MFCD00012567 024 -3.7 -0.1 -3.5 -0.1 MFCD00012488 024 -3.7 -0.1 -3.5 -0.1 MFCD00012469 040 -3.7 -0.1 -0.1 -3.5 MFCD00012267 003 -3.7 -0.1 -0.1 -3.5 MFCD00011979 019 -3.7 -0.1 -0.1 -3.5 MFCD00011939 019 -3.7 -0.1 -0.1 -3.5 MFCD00011926 015 -3.7 -0.1 -0.1 -3.5 MFCD00011663 013 -3.7 -0.1 -0.1 -3.5 MFCD00011393 082 -3.7 -0.1 -0.1 -3.5 MFCD00011236 075 -3.7 -0.1 -0.1 -3.5 MFCD00010959 075 -3.7 -0.1 -0.1 -3.5 MFCD00010748 019 -3.7 -0.1 -0.1 -3.5 MFCD00010553 022 -3.7 -0.1 -0.1 -3.5 MFCD00010544 040 -3.7 -0.1 -0.1 -3.5 MFCD00010507 040 -3.7 -0.1 -0.1 -3.5 MFCD00010505 040 -3.7 -0.1 -0.1 -3.5 MFCD00010480 003 -3.7 -0.1 -0.1 -3.5 MFCD00010469 015 -3.7 -0.1 -0.1 -3.5 MFCD00010404 075 -3.7 -0.1 -0.1 -3.5 MFCD00010169 043 -3.7 -0.1 -0.1 -3.5 MFCD00010073 022 -3.7 -0.1 -0.1 -3.5 MFCD00009940 003 -3.7 -0.1 -0.1 -3.5 MFCD00009831 003 -3.7 -0.1 -0.1 -3.5 MFCD00007888 024 -3.7 -0.1 -3.5 -0.1 MFCD00007682 040 -3.7 -0.1 -0.1 -3.5 MFCD00007646 024 -3.7 -0.1 -3.5 -0.1 MFCD00007587 076 -3.7 -0.1 -0.1 -3.5 MFCD00007515 075 -3.7 -0.1 -0.1 -3.5 MFCD00007477 075 -3.7 -0.1 -0.1 -3.5 MFCD00007468 075 -3.7 -0.1 -0.1 -3.5 MFCD00006709 006 -3.7 -0.1 -3.5 -0.1 MFCD00006616 015 -3.7 -0.1 -0.1 -3.5 MFCD00006544 082 -3.7 -0.1 -0.1 -3.5 MFCD00006543 082 -3.7 -0.1 -0.1 -3.5 MFCD00006524 082 -3.7 -0.1 -0.1 -3.5 MFCD00006523 082 -3.7 -0.1 -0.1 -3.5 MFCD00006165 019 -3.7 -0.1 -0.1 -3.5 MFCD00005845 003 -3.7 -0.1 -3.5 -0.1 MFCD00005761 092 -3.7 -0.1 -0.1 -3.5 MFCD00005175 040 -3.7 -0.1 -0.1 -3.5 MFCD00004592 040 -3.7 -0.1 -0.1 -3.5 MFCD00004356 040 -3.7 -0.1 -0.1 -3.5 MFCD00004292 040 -3.7 -0.1 -0.1 -3.5 MFCD00004289 040 -3.7 -0.1 -0.1 -3.5 MFCD00004286 040 -3.7 -0.1 -0.1 -3.5 MFCD00004227 040 -3.7 -0.1 -0.1 -3.5 MFCD00004175 040 -3.7 -0.1 -0.1 -3.5 MFCD00004090 075 -3.7 -0.1 -0.1 -3.5 MFCD00004012 040 -3.7 -0.1 -0.1 -3.5 MFCD00003993 043 -3.7 -0.1 -0.1 -3.5 MFCD00003885 075 -3.7 -0.1 -0.1 -3.5 MFCD00003663 003 -3.7 -0.1 -0.1 -3.5 MFCD00003650 003 -3.7 -0.1 -0.1 -3.5 MFCD00003617 015 -3.7 -0.1 -0.1 -3.5 MFCD00003616 003 -3.7 -0.1 -0.1 -3.5 MFCD00003612 009 -3.7 -0.1 -0.1 -3.5 MFCD00003607 003 -3.7 -0.1 -0.1 -3.5 MFCD00003606 003 -3.7 -0.1 -0.1 -3.5 MFCD00002809 040 -3.7 -0.1 -0.1 -3.5 MFCD00002742 040 -3.7 -0.1 -0.1 -3.5 MFCD00002544 040 -3.7 -0.1 -0.1 -3.5 MFCD00002543 040 -3.7 -0.1 -0.1 -3.5 MFCD00002444 040 -3.7 -0.1 -0.1 -3.5 MFCD00002443 040 -3.7 -0.1 -0.1 -3.5 MFCD00001551 040 -3.7 -0.1 -0.1 -3.5 MFCD00001230 075 -3.7 -0.1 -0.1 -3.5 MFCD00001229 075 -3.7 -0.1 -0.1 -3.5 MFCD00000803 019 -3.7 -0.1 -0.1 -3.5 MFCD00020049 003 -3.6 -0.1 -0.1 -3.4 MFCD00010481 015 -3.6 -0.1 -0.1 -3.4 MFCD00010161 022 -3.6 -0.1 -0.1 -3.4 MFCD00010074 022 -3.6 -0.1 -0.1 -3.4 MFCD00007476 075 -3.6 -0.1 -0.1 -3.4 MFCD00003700 043 -3.6 -0.1 -0.1 -3.4 MFCD00013049 075 -3.5 -0.1 -0.1 -3.3 MFCD00008359 019 -3.5 -0.1 -0.1 -3.3 MFCD00007517 075 -3.5 -0.1 -0.1 -3.3 MFCD00005740 015 -3.5 -0.1 -0.1 -3.3 MFCD00004214 040 -3.5 -0.1 -0.1 -3.3 MFCD00016929 019 -3.4 -0.1 -0.1 -3.2 MFCD00005763 043 -3.3 -0.1 -0.1 -3.1 MFCD00002665 040 -3.3 -0.1 -0.1 -3.1 MFCD00005171 019 -3.2 -0.1 -0.1 -3.0 MFCD00004215 040 -3.2 -0.1 -0.1 -3.0 MFCD00014899 019 -3.1 -0.1 -0.1 -2.9 MFCD00010117 015 -3.1 -0.1 -0.1 -2.9 MFCD00010266 040 -2.9 -0.1 -0.1 -2.7 MFCD00010277 022 -2.8 -0.1 -0.1 -2.6 MFCD00017310 015 -2.7 -0.1 -2.5 -0.1 MFCD00017308 015 -2.7 -0.1 -2.5 -0.1 MFCD00016962 015 -2.7 -0.1 -2.5 -0.1 MFCD00016940 015 -2.7 -2.5 -0.1 -0.1 MFCD00016927 015 -2.7 -0.1 -2.5 -0.1 MFCD00016780 015 -2.7 -0.1 -2.5 -0.1 MFCD00016779 015 -2.7 -0.1 -2.5 -0.1 MFCD00016771 015 -2.7 -0.1 -2.5 -0.1 MFCD00016663 013 -2.7 -0.1 -2.5 -0.1 MFCD00011944 092 -2.7 -0.1 -0.1 -2.5 MFCD00010576 015 -2.7 -2.5 -0.1 -0.1 MFCD00006828 015 -2.7 -0.1 -2.5 -0.1 MFCD00006827 015 -2.7 -0.1 -2.5 -0.1 MFCD00006826 015 -2.7 -0.1 -2.5 -0.1 MFCD00006606 015 -2.7 -2.5 -0.1 -0.1 MFCD00006600 015 -2.7 -2.5 -0.1 -0.1 MFCD00005741 015 -2.7 -0.1 -2.5 -0.1 MFCD00003979 013 -2.7 -2.5 -0.1 -0.1 MFCD00003689 015 -2.7 -0.1 -2.5 -0.1 EST_09 015 -2.7 -2.5 -0.1 -0.1 MFCD00003629 015 -2.4 -4.0 -0.1 1.7 MFCD00016698 019 -2.4 -0.1 -0.1 -2.2 MFCD00003655 015 -2.4 -0.1 -0.1 -2.2 EST_03 015 -2.4 -2.2 -0.1 -0.1 MFCD00013091 075 -2.3 -0.1 -0.1 -2.1 EST_10 015 -2.3 -0.1 -2.1 -0.1 MFCD00012126 009 -2.1 -0.1 -0.1 -1.9 MFCD00012660 012 -1.9 -0.1 -0.1 -1.7 MFCD00010470 003 -1.7 -0.1 -0.1 -1.5 MFCD00020115 015 -0.3 -0.1 -0.1 -0.1 MFCD00020108 015 -0.3 -0.1 -0.1 -0.1 MFCD00020031 015 -0.3 -0.1 -0.1 -0.1 MFCD00016514 015 -0.3 -0.1 -0.1 -0.1 MFCD00016364 003 -0.3 -0.1 -0.1 -0.1 MFCD00014581 043 -0.3 -0.1 -0.1 -0.1 MFCD00014029 040 -0.3 -0.1 -0.1 -0.1 MFCD00013970 015 -0.3 -0.1 -0.1 -0.1 MFCD00013304 040 -0.3 -0.1 -0.1 -0.1 MFCD00013050 043 -0.3 -0.1 -0.1 -0.1 MFCD00012570 006 -0.3 -0.1 -0.1 -0.1 MFCD00011757 024 -0.3 -0.1 -0.1 -0.1 MFCD00011724 024 -0.3 -0.1 -0.1 -0.1 MFCD00011654 015 -0.3 -0.1 -0.1 -0.1 MFCD00010508 092 -0.3 -0.1 -0.1 -0.1 MFCD00010485 015 -0.3 -0.1 -0.1 -0.1 MFCD00010361 015 -0.3 -0.1 -0.1 -0.1 MFCD00010115 015 -0.3 -0.1 -0.1 -0.1 MFCD00010060 015 -0.3 -0.1 -0.1 -0.1 MFCD00009772 015 -0.3 -0.1 -0.1 -0.1 MFCD00009717 015 -0.3 -0.1 -0.1 -0.1 MFCD00009702 092 -0.3 -0.1 -0.1 -0.1 MFCD00009697 059 -0.3 -0.1 -0.1 -0.1 MFCD00008364 015 -0.3 -0.1 -0.1 -0.1 MFCD00005798 024 -0.3 -0.1 -0.1 -0.1 MFCD00005746 015 -0.3 -0.1 -0.1 -0.1 MFCD00004291 040 -0.3 -0.1 -0.1 -0.1 MFCD00004274 015 -0.3 -0.1 -0.1 -0.1 MFCD00003682 015 -0.3 -0.1 -0.1 -0.1 MFCD00003681 015 -0.3 -0.1 -0.1 -0.1 MFCD00003680 015 -0.3 -0.1 -0.1 -0.1 MFCD00003679 015 -0.3 -0.1 -0.1 -0.1 MFCD00003678 015 -0.3 -0.1 -0.1 -0.1 MFCD00003673 015 -0.3 -0.1 -0.1 -0.1 MFCD00003672 015 -0.3 -0.1 -0.1 -0.1 MFCD00003671 015 -0.3 -0.1 -0.1 -0.1 MFCD00003670 015 -0.3 -0.1 -0.1 -0.1 MFCD00003649 015 -0.3 -0.1 -0.1 -0.1 MFCD00003569 024 -0.3 -0.1 -0.1 -0.1 MFCD00002755 040 -0.3 -0.1 -0.1 -0.1 MFCD00002594 015 -0.3 -0.1 -0.1 -0.1 MFCD00001845 046 -0.3 -0.1 -0.1 -0.1 MFCD00001657 006 -0.3 -0.1 -0.1 -0.1 MFCD00001618 003 -0.3 -0.1 -0.1 -0.1 MFCD00001617 015 -0.3 -0.1 -0.1 -0.1 MFCD00000439 015 -0.3 -0.1 -0.1 -0.1 EST_04 015 -0.3 -0.1 -0.1 -0.1