Study : 228_tI_CAPAN (atomeDB@cbs.cnrs.fr)


Main Binding Site Prediction:


Binding Site Prediction

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Binding Site Number :C3_S1
Best Complexes choosen after comparative docking [pKd > 3] : 2 (5 maxi)

Complexes [Theoretical pKd]FileVolume (A3)
(FPocket)
Hydrophobicity
Score(FPocket)
Contacts Ligand/Receptor [<4A] in Site C3_S1
Complex: LPC_A_4(1BWO) / Model_14(1BWO/A) = [4.2] Download1324.7855.20LTCGQVQSRMTPCLPYLTGSGPLGRCCGGVKGLLGAAKTPADRKTVCTCLKSAAGSIGGINVRKAAGLPNMCGVNIPYQISPSADCTKVQ
Complex: OLA_A_2(1FK5) / Model_29(1FK5/A) = [5.6] Download1080.6351.72LTCGQVQSRMTPCLPYLTGSGPLGRCCGGVKGLLGAAKTPADRKTVCTCLKSAAGSIGGINVRKAAGLPNMCGVNIPYQISPSADCTKVQ
Consensus
[pKd Mean = 4.90]
-1202
(s=122)
53
(s=1)
LTCGQVQSRMTPCLPYLTGSGPLGRCCGGVKGLLGAAKTPADRKTVCTCLKSAAGSIGGINVRKAAGLPNMCGVNIPYQISPSADCTKVQ