Study : C5FE38_ARTOC (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: ADP_A_4(1L8T) / Model_55(1L8T/A) = [3.8] Download867.3013.04MSDAMTQGNFVYAFLKSCFTRLRGFAQFLLPFLRPKKRRGINYYNPVELNKYAMQTLQKALKDDPGADIRDCLPLVYNSAMRVISKTKARKEEELKRPPTPEFRTKINYVENAEIIFPLSDEVVSLLLQYSDKDGELVGKQLVISLKQLIWESPKIWESAVRGVVLKCSDNVALKVIRQHPDYTEYTTLQYLAEKLPEIPVPSTYGVIRFKPFTAYFMSYIPSMTLAEAWPSLNHEGKTSVQEQLEEIFSKLRTLRKDDGYPLGGVGGEGVKEARVGNSAQEKTINTAASFVDLQFSLSEFLSKSYIQFIRTLQPPPPTGSVFTHGDVRKDNIMVDIGDNNTCTVTAIIDWEDAGFYPDYFECTTLTRTWLPHVEDDWYNYLPPCIDPARFPHHWLIDRLWGIHHPIF
Complex: ANP_A_2(3TM0) / Model_54(3TM0/A) = [3.8] Download1577.8210.46MSDAMTQGNFVYAFLKSCFTRLRGFAQFLLPFLRPKKRRGINYYNPVELNKYAMQTLQKALKDDPGADIRDCLPLVYNSAMRVISKTKARKEEELKRPPTPEFRTKINYVENAEIIFPLSDEVVSLLLQYSDKDGELVGKQLVISLKQLIWESPKIWESAVRGVVLKCSDNVALKVIRQHPDYTEYTTLQYLAEKLPEIPVPSTYGVIRFKPFTAYFMSYIPSMTLAEAWPSLNHEGKTSVQEQLEEIFSKLRTLRKDDGYPLGGVGGEGVKEARVGNSAQEKTINTAASFVDLQFSLSEFLSKSYIQFIRTLQPPPPTGSVFTHGDVRKDNIMVDIGDNNTCTVTAIIDWEDAGFYPDYFECTTLTRTWLPHVEDDWYNYLPPCIDPARFPHHWLIDRLWGIHHPIF
Complex: ADP_A_7(1J7L) / Model_21(1J7L/A) = [5.0] Download842.3822.56MSDAMTQGNFVYAFLKSCFTRLRGFAQFLLPFLRPKKRRGINYYNPVELNKYAMQTLQKALKDDPGADIRDCLPLVYNSAMRVISKTKARKEEELKRPPTPEFRTKINYVENAEIIFPLSDEVVSLLLQYSDKDGELVGKQLVISLKQLIWESPKIWESAVRGVVLKCSDNVALKVIRQHPDYTEYTTLQYLAEKLPEIPVPSTYGVIRFKPFTAYFMSYIPSMTLAEAWPSLNHEGKTSVQEQLEEIFSKLRTLRKDDGYPLGGVGGEGVKEARVGNSAQEKTINTAASFVDLQFSLSEFLSKSYIQFIRTLQPPPPTGSVFTHGDVRKDNIMVDIGDNNTCTVTAIIDWEDAGFYPDYFECTTLTRTWLPHVEDDWYNYLPPCIDPARFPHHWLIDRLWGIHHPIF
Consensus
[pKd Mean = 4.20]
-1095
(s=340)
15
(s=5)
MSDAMTQGNFVYAFLKSCFTRLRGFAQFLLPFLRPKKRRGINYYNPVELNKYAMQTLQKALKDDPGADIRDCLPLVYNSAMRVISKTKARKEEELKRPPTPEFRTKINYVENAEIIFPLSDEVVSLLLQYSDKDGELVGKQLVISLKQLIWESPKIWESAVRGVVLKCSDNVALKVIRQHPDYTEYTTLQYLAEKLPEIPVPSTYGVIRFKPFTAYFMSYIPSMTLAEAWPSLNHEGKTSVQEQLEEIFSKLRTLRKDDGYPLGGVGGEGVKEARVGNSAQEKTINTAASFVDLQFSLSEFLSKSYIQFIRTLQPPPPTGSVFTHGDVRKDNIMVDIGDNNTCTVTAIIDWEDAGFYPDYFECTTLTRTWLPHVEDDWYNYLPPCIDPARFPHHWLIDRLWGIHHPIF