Study : 515_tI_POPTR (atomeDB@cbs.cnrs.fr)


Main Binding Site Prediction:


Binding Site Prediction

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Binding Site Number :C2_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 C2_S1
Complex: DAO_E_5(2ALG) / Model_20(2ALG/A) = [4.1] Download659.6634.90AISCNQVINTLTPCISYVVGNGALTGNCCNAIRGLNSAARTTPDRQSVCTCLKNTASQFSYNSRNVALAAGLPGKCGVKLPYKIDPSTDCKSVK
Complex: OLA_A_2(1FK5) / Model_10(1FK5/A) = [4.9] Download1098.8741.48AISCNQVINTLTPCISYVVGNGALTGNCCNAIRGLNSAARTTPDRQSVCTCLKNTASQFSYNSRNVALAAGLPGKCGVKLPYKIDPSTDCKSVK
Consensus
[pKd Mean = 4.50]
-879
(s=219)
38
(s=3)
AISCNQVINTLTPCISYVVGNGALTGNCCNAIRGLNSAARTTPDRQSVCTCLKNTASQFSYNSRNVALAAGLPGKCGVKLPYKIDPSTDCKSVK