Study : 034_tI_WHEAT (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_23(2ALG/A) = [3.1] Download684.4043.48AVTCGDVTSAVAPCMSYARGQASAPSGACCSGVRTLNAKASTPADRKAACNCLKNLAGSGISMGNAANIPGKCGVSVSFPINTKTNCNNLH
Complex: LPC_A_4(1BWO) / Model_25(1BWO/A) = [4.2] Download1223.9545.00AVTCGDVTSAVAPCMSYARGQASAPSGACCSGVRTLNAKASTPADRKAACNCLKNLAGSGISMGNAANIPGKCGVSVSFPINTKTNCNNLH
Complex: OLA_A_2(1FK5) / Model_10(1FK5/A) = [5.9] Download1288.7642.15AVTCGDVTSAVAPCMSYARGQASAPSGACCSGVRTLNAKASTPADRKAACNCLKNLAGSGISMGNAANIPGKCGVSVSFPINTKTNCNNLH
Consensus
[pKd Mean = 4.40]
-1065
(s=270)
43
(s=1)
AVTCGDVTSAVAPCMSYARGQASAPSGACCSGVRTLNAKASTPADRKAACNCLKNLAGSGISMGNAANIPGKCGVSVSFPINTKTNCNNLH