Study : 200_tI_ATRNU (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] : 3 (5 maxi)

Complexes [Theoretical pKd]FileVolume (A3)
(FPocket)
Hydrophobicity
Score(FPocket)
Contacts Ligand/Receptor [<4A] in Site C2_S1
Complex: LPC_A_4(1BWO) / Model_16(1BWO/A) = [4.0] Download1393.3955.20LTCGQVTSSMTPCMSYLTGGGSPTPACCGGVKSLNSMASTPADRKAACGCLKSAAGAMTNLNMGNAASLPGKCGISLPYPISTSTDCSKVN
Complex: OLA_A_2(1FK5) / Model_31(1FK5/A) = [6.1] Download1141.9648.11LTCGQVTSSMTPCMSYLTGGGSPTPACCGGVKSLNSMASTPADRKAACGCLKSAAGAMTNLNMGNAASLPGKCGISLPYPISTSTDCSKVN
Complex: LPC_A_3(1BWO) / Model_16(1BWO/A) = [6.8] Download1718.0845.17LTCGQVTSSMTPCMSYLTGGGSPTPACCGGVKSLNSMASTPADRKAACGCLKSAAGAMTNLNMGNAASLPGKCGISLPYPISTSTDCSKVN
Consensus
[pKd Mean = 5.63]
-1417
(s=235)
49
(s=4)
LTCGQVTSSMTPCMSYLTGGGSPTPACCGGVKSLNSMASTPADRKAACGCLKSAAGAMTNLNMGNAASLPGKCGISLPYPISTSTDCSKVN