Study : Wbm0168 (atomeDB@cbs.cnrs.fr)


Main Binding Site Prediction:


Binding Site Prediction

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Binding Site Number :C5_S1
Best Complexes choosen after comparative docking [pKd > 3] : 5 (5 maxi)

Complexes [Theoretical pKd]FileVolume (A3)
(FPocket)
Hydrophobicity
Score(FPocket)
Contacts Ligand/Receptor [<4A] in Site C5_S1
Complex: CHAIN_E_1(2B3J) / Model_2(2B3J/A) = [7.3] Download--MEFAVEQAKLAKKNDEIPIGAVIVSGDNIISFAHNISNDPTAHAEMLVIRQACELLSTSVLCNADMYVTLEPCPMCAQAISFARIKRLYFGAYNSKGGGIENGAKIFQFCSHVPEVYGGVLETECSFLLKDFFEKLRDSTNYY
Complex: CHAIN_E_1(2B3J) / Model_48(2B3J/A) = [7.5] Download--MEFAVEQAKLAKKNDEIPIGAVIVSGDNIISFAHNISNDPTAHAEMLVIRQACELLSTSVLCNADMYVTLEPCPMCAQAISFARIKRLYFGAYNSKGGGIENGAKIFQFCSHVPEVYGGVLETECSFLLKDFFEKLRDSTNYY
Complex: CHAIN_G_3(2B3J) / Model_23(2B3J/C) = [7.7] Download--MEFAVEQAKLAKKNDEIPIGAVIVSGDNIISFAHNISNDPTAHAEMLVIRQACELLSTSVLCNADMYVTLEPCPMCAQAISFARIKRLYFGAYNSKGGGIENGAKIFQFCSHVPEVYGGVLETECSFLLKDFFEKLRDSTNYY
Complex: CHAIN_F_2(2B3J) / Model_24(2B3J/B) = [8.8] Download--MEFAVEQAKLAKKNDEIPIGAVIVSGDNIISFAHNISNDPTAHAEMLVIRQACELLSTSVLCNADMYVTLEPCPMCAQAISFARIKRLYFGAYNSKGGGIENGAKIFQFCSHVPEVYGGVLETECSFLLKDFFEKLRDSTNYY
Complex: CHAIN_H_4(2B3J) / Model_22(2B3J/D) = [8.9] Download--MEFAVEQAKLAKKNDEIPIGAVIVSGDNIISFAHNISNDPTAHAEMLVIRQACELLSTSVLCNADMYVTLEPCPMCAQAISFARIKRLYFGAYNSKGGGIENGAKIFQFCSHVPEVYGGVLETECSFLLKDFFEKLRDSTNYY
Consensus
[pKd Mean = 8.04]
-0
(s=0)
0
(s=0)
MEFAVEQAKLAKKNDEIPIGAVIVSGDNIISFAHNISNDPTAHAEMLVIRQACELLSTSVLCNADMYVTLEPCPMCAQAISFARIKRLYFGAYNSKGGGIENGAKIFQFCSHVPEVYGGVLETECSFLLKDFFEKLRDSTNYY