Study : 386_tI_SOLTU (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: DAO_E_5(2ALG) / Model_12(2ALG/A) = [3.9] Download770.9638.83LSCGEVTSGLAPCLPYLQGRGPIGGCCGGVKGLLGAAKTPEDRKTACTCLKSAANSIKGIDTGKAAGLPGVCGVSIPYKISPSTDCSKVQ
Complex: LPC_A_4(1BWO) / Model_15(1BWO/A) = [4.3] Download1327.9253.27LSCGEVTSGLAPCLPYLQGRGPIGGCCGGVKGLLGAAKTPEDRKTACTCLKSAANSIKGIDTGKAAGLPGVCGVSIPYKISPSTDCSKVQ
Complex: OLA_A_2(1FK5) / Model_31(1FK5/A) = [5.7] Download1032.6752.15LSCGEVTSGLAPCLPYLQGRGPIGGCCGGVKGLLGAAKTPEDRKTACTCLKSAANSIKGIDTGKAAGLPGVCGVSIPYKISPSTDCSKVQ
Consensus
[pKd Mean = 4.63]
-1043
(s=227)
48
(s=6)
LSCGEVTSGLAPCLPYLQGRGPIGGCCGGVKGLLGAAKTPEDRKTACTCLKSAANSIKGIDTGKAAGLPGVCGVSIPYKISPSTDCSKVQ