Study : 263_tI_HORVU (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] : 3 (5 maxi)

Complexes [Theoretical pKd]FileVolume (A3)
(FPocket)
Hydrophobicity
Score(FPocket)
Contacts Ligand/Receptor [<4A] in Site C3_S1
Complex: HP6_G_7(2ALG) / Model_21(2ALG/A) = [3.2] Download583.8250.94AISCGQVSSALRPCISYASGNGGILPPACCSGVKRLAGAAQSTADKQAVCKCIKSAAAGLNAGKAAGIPSKCGVSVPYSISTSVDCSKIH
Complex: LPC_A_4(1BWO) / Model_25(1BWO/A) = [4.0] Download1546.5944.04AISCGQVSSALRPCISYASGNGGILPPACCSGVKRLAGAAQSTADKQAVCKCIKSAAAGLNAGKAAGIPSKCGVSVPYSISTSVDCSKIH
Complex: OLA_A_2(1FK5) / Model_11(1FK5/A) = [6.3] Download1013.2247.46AISCGQVSSALRPCISYASGNGGILPPACCSGVKRLAGAAQSTADKQAVCKCIKSAAAGLNAGKAAGIPSKCGVSVPYSISTSVDCSKIH
Consensus
[pKd Mean = 4.50]
-1047
(s=393)
47
(s=2)
AISCGQVSSALRPCISYASGNGGILPPACCSGVKRLAGAAQSTADKQAVCKCIKSAAAGLNAGKAAGIPSKCGVSVPYSISTSVDCSKIH