| Complexes [Theoretical pKd] | File | Volume (A3)
(FPocket) | Hydrophobicity
Score(FPocket) | Contacts Ligand/Receptor [<4A] in Site C3_S1 |
| Complex: HGY_B_8(4PXC) / Model_25(4PXC/B) = [3.1]
| Download | 319.60 | 6.50 | MQTNLERIKKHIEKLDTFTATPGQGTTRLTYSKEDLDARNYLKQEMAKVGLTVSEDAIGNIYGRLEGESPDLPAVIVGSHFDSVPNGGAFDGPAGVITGLEVASVFHEQQIKPHFPLEIIAMVEEEGSRFGAGLLASRAITGKVTTEMLHEMKDIDGITATDAMAKLGFNANRVHRAIRTKESVKAFIELHIEQGPILENASEDVALVDTVVGLTQIKVTVKGQAGHAGTTPMLDRKDALVSAVEILGQLPELAIQEGGGTVLTVGKLNVYPNGANVIPDKVIFTVDIRAKDEIHVQNTLAKTKEIIQATEKNGITCEIKDMIYQQPTHLSKEIHQALTESADQLGFKYRTMVSGAGHDAMIFASLTEVGLIFVPSHNGISHAPEEWTDYDKLQKGIEVVLKTVKKWTEESANESENKTNSFK |
| Complex: HGY_A_5(4PXC) / Model_6(4PXC/A) = [3.2]
| Download | 382.59 | 7.60 | MQTNLERIKKHIEKLDTFTATPGQGTTRLTYSKEDLDARNYLKQEMAKVGLTVSEDAIGNIYGRLEGESPDLPAVIVGSHFDSVPNGGAFDGPAGVITGLEVASVFHEQQIKPHFPLEIIAMVEEEGSRFGAGLLASRAITGKVTTEMLHEMKDIDGITATDAMAKLGFNANRVHRAIRTKESVKAFIELHIEQGPILENASEDVALVDTVVGLTQIKVTVKGQAGHAGTTPMLDRKDALVSAVEILGQLPELAIQEGGGTVLTVGKLNVYPNGANVIPDKVIFTVDIRAKDEIHVQNTLAKTKEIIQATEKNGITCEIKDMIYQQPTHLSKEIHQALTESADQLGFKYRTMVSGAGHDAMIFASLTEVGLIFVPSHNGISHAPEEWTDYDKLQKGIEVVLKTVKKWTEESANESENKTNSFK |
| Complex: UGC_A_5(4PXB) / Model_5(4PXB/A) = [3.6]
| Download | 406.96 | 3.18 | MQTNLERIKKHIEKLDTFTATPGQGTTRLTYSKEDLDARNYLKQEMAKVGLTVSEDAIGNIYGRLEGESPDLPAVIVGSHFDSVPNGGAFDGPAGVITGLEVASVFHEQQIKPHFPLEIIAMVEEEGSRFGAGLLASRAITGKVTTEMLHEMKDIDGITATDAMAKLGFNANRVHRAIRTKESVKAFIELHIEQGPILENASEDVALVDTVVGLTQIKVTVKGQAGHAGTTPMLDRKDALVSAVEILGQLPELAIQEGGGTVLTVGKLNVYPNGANVIPDKVIFTVDIRAKDEIHVQNTLAKTKEIIQATEKNGITCEIKDMIYQQPTHLSKEIHQALTESADQLGFKYRTMVSGAGHDAMIFASLTEVGLIFVPSHNGISHAPEEWTDYDKLQKGIEVVLKTVKKWTEESANESENKTNSFK |
| Complex: UGC_B_8(4PXB) / Model_26(4PXB/B) = [5.2]
| Download | 370.04 | 6.81 | MQTNLERIKKHIEKLDTFTATPGQGTTRLTYSKEDLDARNYLKQEMAKVGLTVSEDAIGNIYGRLEGESPDLPAVIVGSHFDSVPNGGAFDGPAGVITGLEVASVFHEQQIKPHFPLEIIAMVEEEGSRFGAGLLASRAITGKVTTEMLHEMKDIDGITATDAMAKLGFNANRVHRAIRTKESVKAFIELHIEQGPILENASEDVALVDTVVGLTQIKVTVKGQAGHAGTTPMLDRKDALVSAVEILGQLPELAIQEGGGTVLTVGKLNVYPNGANVIPDKVIFTVDIRAKDEIHVQNTLAKTKEIIQATEKNGITCEIKDMIYQQPTHLSKEIHQALTESADQLGFKYRTMVSGAGHDAMIFASLTEVGLIFVPSHNGISHAPEEWTDYDKLQKGIEVVLKTVKKWTEESANESENKTNSFK |
Consensus
[pKd Mean = 3.78] | - | 369
(s=31) | 6
(s=1) | MQTNLERIKKHIEKLDTFTATPGQGTTRLTYSKEDLDARNYLKQEMAKVGLTVSEDAIGNIYGRLEGESPDLPAVIVGSHFDSVPNGGAFDGPAGVITGLEVASVFHEQQIKPHFPLEIIAMVEEEGSRFGAGLLASRAITGKVTTEMLHEMKDIDGITATDAMAKLGFNANRVHRAIRTKESVKAFIELHIEQGPILENASEDVALVDTVVGLTQIKVTVKGQAGHAGTTPMLDRKDALVSAVEILGQLPELAIQEGGGTVLTVGKLNVYPNGANVIPDKVIFTVDIRAKDEIHVQNTLAKTKEIIQATEKNGITCEIKDMIYQQPTHLSKEIHQALTESADQLGFKYRTMVSGAGHDAMIFASLTEVGLIFVPSHNGISHAPEEWTDYDKLQKGIEVVLKTVKKWTEESANESENKTNSFK |