Study : C5CJ43_KOSOT (atomeDB@cbs.cnrs.fr)


Main Binding Site Prediction:


Binding Site Prediction

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Binding Site Number :C6_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 C6_S1
Complex: GNP_C_13(5IQI) / Model_43(5IQI/C) = [3.2] Download1272.7210.58MIINEEVIWIVNSLVGEFEIIKDHRNSSNRTGVLEINANNKRMFIKIHNRLSRWSPEVYAYKNWTHILGEYAPRLIHSFNDDNFYGIITTPIYGKTVNEYQINDEDILEPIYYKAGELLKQLHNNFKGTYFGIPAIDGSPLESKAKTDPVDYINSALEDILKSGYDKGLFNNSDKELVKWCMKHSDVFANSKPVPTNWDFSQNNWMVDEDGKFTGFIDFENMLWGIDVDSFGIVIERYTPNRPKLRKALFEGYGLENSEEKQLQLKIVSVKMAIADITYGASVGNDRIFSLGRNLMDNLKMPGFKIH
Complex: GNP_A_5(5IQC) / Model_49(5IQC/A) = [3.7] Download1247.8413.04MIINEEVIWIVNSLVGEFEIIKDHRNSSNRTGVLEINANNKRMFIKIHNRLSRWSPEVYAYKNWTHILGEYAPRLIHSFNDDNFYGIITTPIYGKTVNEYQINDEDILEPIYYKAGELLKQLHNNFKGTYFGIPAIDGSPLESKAKTDPVDYINSALEDILKSGYDKGLFNNSDKELVKWCMKHSDVFANSKPVPTNWDFSQNNWMVDEDGKFTGFIDFENMLWGIDVDSFGIVIERYTPNRPKLRKALFEGYGLENSEEKQLQLKIVSVKMAIADITYGASVGNDRIFSLGRNLMDNLKMPGFKIH
Complex: ADP_A_7(1J7L) / Model_22(1J7L/A) = [6.5] Download933.8810.10MIINEEVIWIVNSLVGEFEIIKDHRNSSNRTGVLEINANNKRMFIKIHNRLSRWSPEVYAYKNWTHILGEYAPRLIHSFNDDNFYGIITTPIYGKTVNEYQINDEDILEPIYYKAGELLKQLHNNFKGTYFGIPAIDGSPLESKAKTDPVDYINSALEDILKSGYDKGLFNNSDKELVKWCMKHSDVFANSKPVPTNWDFSQNNWMVDEDGKFTGFIDFENMLWGIDVDSFGIVIERYTPNRPKLRKALFEGYGLENSEEKQLQLKIVSVKMAIADITYGASVGNDRIFSLGRNLMDNLKMPGFKIH
Consensus
[pKd Mean = 4.47]
-1151
(s=154)
11
(s=1)
MIINEEVIWIVNSLVGEFEIIKDHRNSSNRTGVLEINANNKRMFIKIHNRLSRWSPEVYAYKNWTHILGEYAPRLIHSFNDDNFYGIITTPIYGKTVNEYQINDEDILEPIYYKAGELLKQLHNNFKGTYFGIPAIDGSPLESKAKTDPVDYINSALEDILKSGYDKGLFNNSDKELVKWCMKHSDVFANSKPVPTNWDFSQNNWMVDEDGKFTGFIDFENMLWGIDVDSFGIVIERYTPNRPKLRKALFEGYGLENSEEKQLQLKIVSVKMAIADITYGASVGNDRIFSLGRNLMDNLKMPGFKIH