Study : G8PTR3_PSEUV (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] : 1 (5 maxi)

Complexes [Theoretical pKd]FileVolume (A3)
(FPocket)
Hydrophobicity
Score(FPocket)
Contacts Ligand/Receptor [<4A] in Site C3_S1
Complex: EDO_A_10(5FTG) / Model_71(5FTG/A) = [3.1] Download818.5514.80MTETLTKELAVTKALELPFWKAPSNAEILGGGITNFNVKITDEGRTYVVRLGEDIVEHGVMRFNELSACRAAHAAGVAPAVRYFQKGALVQDYIPADPLVEEEIQQLKMLELIAALLGKVHRDATQLIRGPVLAFWVFHILRDYTETLRLLDSDHISKLDDLMQKAQKLEAAVGNVHLVLCHNDLLPANILNENGRLWLVDWEYAGMNSPLFDLGGLATNAGLSEGLQKLLLETYFDTPVSDELWERYNAMKCASLLRESMWSMVSEQTSKIQFDYADYTRENLLRFERAFAELQLK
Consensus
[pKd Mean = 3.10]
-818
(s=0)
14
(s=0)
MTETLTKELAVTKALELPFWKAPSNAEILGGGITNFNVKITDEGRTYVVRLGEDIVEHGVMRFNELSACRAAHAAGVAPAVRYFQKGALVQDYIPADPLVEEEIQQLKMLELIAALLGKVHRDATQLIRGPVLAFWVFHILRDYTETLRLLDSDHISKLDDLMQKAQKLEAAVGNVHLVLCHNDLLPANILNENGRLWLVDWEYAGMNSPLFDLGGLATNAGLSEGLQKLLLETYFDTPVSDELWERYNAMKCASLLRESMWSMVSEQTSKIQFDYADYTRENLLRFERAFAELQLK