| Complexes [Theoretical pKd] | File | Volume (A3)
(FPocket) | Hydrophobicity
Score(FPocket) | Contacts Ligand/Receptor [<4A] in Site C2_S1 |
| Complex: ADP_B_8(2O1V) / Model_23(2O1V/B) = [4.5]
| Download | 1199.17 | 24.16 | MMELKMHNVKGTENLKFDAEVGKVLNIVIHSLYTNKDIFLRELVSNASDACDKLRYESQLNPNLLDSSGELKITISSNKDENELYVTDNGIGMSRQDLIGNLGTIASSGTQKFLDAIKNSKDSSQAVELIGKFGVGFYSSFMVASEVIVESRKAGEEESWVWRSTGDGEYSISKLDNQIPCGTKITLVMRPEENEFLDKFRIENIVTTYSDHINFPVEFIDEEGKSEKLNSKAAIWTKLKNDVTQEEHNDFFRGVAHVGGEPWMILHNKNEGAIEYTNLLYVPSIKPFDLFHPDRRCSVKLYVNKVFITEDNVQIIPQYLRFLKGVVDSPDLPLNISRETLQNNRVVEQIRKSLTKRVISELGKKAKENLEEYTKFWTNFGAVLKEGLCEAMPTEEREALLSICRFHSTGDKKLVSIDDYISRMKPEQGYIYYLTGNSLDSVKNSPQLEGFISKGLEVLLFVDPVDDFWTSVIHEYKGQKFKSVTRADVDLEKFSPEEKDKENKSDEERAEGNTDSILQYFTKVLGNAVKSVKISKKLTDSPVCLAVDEGAMDLRMERFLREQNQLNYRTPKVLEVNTKHSVIKSIIKSYAENGENPTLEDMVHLLFYQACIVEGEEMDDASLFAKKLNNLLGKVII |
| Complex: ANP_A_8(2O1U) / Model_101(2O1U/A) = [4.6]
| Download | 1391.95 | 24.16 | MMELKMHNVKGTENLKFDAEVGKVLNIVIHSLYTNKDIFLRELVSNASDACDKLRYESQLNPNLLDSSGELKITISSNKDENELYVTDNGIGMSRQDLIGNLGTIASSGTQKFLDAIKNSKDSSQAVELIGKFGVGFYSSFMVASEVIVESRKAGEEESWVWRSTGDGEYSISKLDNQIPCGTKITLVMRPEENEFLDKFRIENIVTTYSDHINFPVEFIDEEGKSEKLNSKAAIWTKLKNDVTQEEHNDFFRGVAHVGGEPWMILHNKNEGAIEYTNLLYVPSIKPFDLFHPDRRCSVKLYVNKVFITEDNVQIIPQYLRFLKGVVDSPDLPLNISRETLQNNRVVEQIRKSLTKRVISELGKKAKENLEEYTKFWTNFGAVLKEGLCEAMPTEEREALLSICRFHSTGDKKLVSIDDYISRMKPEQGYIYYLTGNSLDSVKNSPQLEGFISKGLEVLLFVDPVDDFWTSVIHEYKGQKFKSVTRADVDLEKFSPEEKDKENKSDEERAEGNTDSILQYFTKVLGNAVKSVKISKKLTDSPVCLAVDEGAMDLRMERFLREQNQLNYRTPKVLEVNTKHSVIKSIIKSYAENGENPTLEDMVHLLFYQACIVEGEEMDDASLFAKKLNNLLGKVII |
| Complex: ANP_A_8(2O1U) / Model_122(2O1U/A) = [4.6]
| Download | 1271.24 | 24.16 | MMELKMHNVKGTENLKFDAEVGKVLNIVIHSLYTNKDIFLRELVSNASDACDKLRYESQLNPNLLDSSGELKITISSNKDENELYVTDNGIGMSRQDLIGNLGTIASSGTQKFLDAIKNSKDSSQAVELIGKFGVGFYSSFMVASEVIVESRKAGEEESWVWRSTGDGEYSISKLDNQIPCGTKITLVMRPEENEFLDKFRIENIVTTYSDHINFPVEFIDEEGKSEKLNSKAAIWTKLKNDVTQEEHNDFFRGVAHVGGEPWMILHNKNEGAIEYTNLLYVPSIKPFDLFHPDRRCSVKLYVNKVFITEDNVQIIPQYLRFLKGVVDSPDLPLNISRETLQNNRVVEQIRKSLTKRVISELGKKAKENLEEYTKFWTNFGAVLKEGLCEAMPTEEREALLSICRFHSTGDKKLVSIDDYISRMKPEQGYIYYLTGNSLDSVKNSPQLEGFISKGLEVLLFVDPVDDFWTSVIHEYKGQKFKSVTRADVDLEKFSPEEKDKENKSDEERAEGNTDSILQYFTKVLGNAVKSVKISKKLTDSPVCLAVDEGAMDLRMERFLREQNQLNYRTPKVLEVNTKHSVIKSIIKSYAENGENPTLEDMVHLLFYQACIVEGEEMDDASLFAKKLNNLLGKVII |
| Complex: ANP_A_8(2O1U) / Model_4(2O1U/A) = [4.6]
| Download | 1428.35 | 24.16 | MMELKMHNVKGTENLKFDAEVGKVLNIVIHSLYTNKDIFLRELVSNASDACDKLRYESQLNPNLLDSSGELKITISSNKDENELYVTDNGIGMSRQDLIGNLGTIASSGTQKFLDAIKNSKDSSQAVELIGKFGVGFYSSFMVASEVIVESRKAGEEESWVWRSTGDGEYSISKLDNQIPCGTKITLVMRPEENEFLDKFRIENIVTTYSDHINFPVEFIDEEGKSEKLNSKAAIWTKLKNDVTQEEHNDFFRGVAHVGGEPWMILHNKNEGAIEYTNLLYVPSIKPFDLFHPDRRCSVKLYVNKVFITEDNVQIIPQYLRFLKGVVDSPDLPLNISRETLQNNRVVEQIRKSLTKRVISELGKKAKENLEEYTKFWTNFGAVLKEGLCEAMPTEEREALLSICRFHSTGDKKLVSIDDYISRMKPEQGYIYYLTGNSLDSVKNSPQLEGFISKGLEVLLFVDPVDDFWTSVIHEYKGQKFKSVTRADVDLEKFSPEEKDKENKSDEERAEGNTDSILQYFTKVLGNAVKSVKISKKLTDSPVCLAVDEGAMDLRMERFLREQNQLNYRTPKVLEVNTKHSVIKSIIKSYAENGENPTLEDMVHLLFYQACIVEGEEMDDASLFAKKLNNLLGKVII |
| Complex: ANP_B_9(2O1U) / Model_24(2O1U/B) = [4.8]
| Download | 1406.43 | 23.54 | MMELKMHNVKGTENLKFDAEVGKVLNIVIHSLYTNKDIFLRELVSNASDACDKLRYESQLNPNLLDSSGELKITISSNKDENELYVTDNGIGMSRQDLIGNLGTIASSGTQKFLDAIKNSKDSSQAVELIGKFGVGFYSSFMVASEVIVESRKAGEEESWVWRSTGDGEYSISKLDNQIPCGTKITLVMRPEENEFLDKFRIENIVTTYSDHINFPVEFIDEEGKSEKLNSKAAIWTKLKNDVTQEEHNDFFRGVAHVGGEPWMILHNKNEGAIEYTNLLYVPSIKPFDLFHPDRRCSVKLYVNKVFITEDNVQIIPQYLRFLKGVVDSPDLPLNISRETLQNNRVVEQIRKSLTKRVISELGKKAKENLEEYTKFWTNFGAVLKEGLCEAMPTEEREALLSICRFHSTGDKKLVSIDDYISRMKPEQGYIYYLTGNSLDSVKNSPQLEGFISKGLEVLLFVDPVDDFWTSVIHEYKGQKFKSVTRADVDLEKFSPEEKDKENKSDEERAEGNTDSILQYFTKVLGNAVKSVKISKKLTDSPVCLAVDEGAMDLRMERFLREQNQLNYRTPKVLEVNTKHSVIKSIIKSYAENGENPTLEDMVHLLFYQACIVEGEEMDDASLFAKKLNNLLGKVII |
Consensus
[pKd Mean = 4.62] | - | 1339
(s=88) | 24
(s=0) | MMELKMHNVKGTENLKFDAEVGKVLNIVIHSLYTNKDIFLRELVSNASDACDKLRYESQLNPNLLDSSGELKITISSNKDENELYVTDNGIGMSRQDLIGNLGTIASSGTQKFLDAIKNSKDSSQAVELIGKFGVGFYSSFMVASEVIVESRKAGEEESWVWRSTGDGEYSISKLDNQIPCGTKITLVMRPEENEFLDKFRIENIVTTYSDHINFPVEFIDEEGKSEKLNSKAAIWTKLKNDVTQEEHNDFFRGVAHVGGEPWMILHNKNEGAIEYTNLLYVPSIKPFDLFHPDRRCSVKLYVNKVFITEDNVQIIPQYLRFLKGVVDSPDLPLNISRETLQNNRVVEQIRKSLTKRVISELGKKAKENLEEYTKFWTNFGAVLKEGLCEAMPTEEREALLSICRFHSTGDKKLVSIDDYISRMKPEQGYIYYLTGNSLDSVKNSPQLEGFISKGLEVLLFVDPVDDFWTSVIHEYKGQKFKSVTRADVDLEKFSPEEKDKENKSDEERAEGNTDSILQYFTKVLGNAVKSVKISKKLTDSPVCLAVDEGAMDLRMERFLREQNQLNYRTPKVLEVNTKHSVIKSIIKSYAENGENPTLEDMVHLLFYQACIVEGEEMDDASLFAKKLNNLLGKVII |