Binding Site Information :
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Information extracted from the bests complexes created by comparative docking.



Prediction Binding Site :


Binding Site Prediction
[Download fasta file] - [Download text file]

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: NACID_S_6(3R2D) / Model_80(3R2D/J) = [3.6] Download--MISSAKKREVATRPDALPRTSVTEIFVELCLLFKIGEGGNKMAKQKIRIRLKAYEHRILDQSADKIVETAKRTGASVSGPIPLPTERSLYTIIRATHKYKDSREQFEMRTHKRLIDIVNPTPKTVDALMKLDLPSGVNIEIKL
Consensus
[pKd Mean = 3.60]		-0
(s=0)		0
(s=0)		MISSAKKREVATRPDALPRTSVTEIFVELCLLFKIGEGGNKMAKQKIRIRLKAYEHRILDQSADKIVETAKRTGASVSGPIPLPTERSLYTIIRATHKYKDSREQFEMRTHKRLIDIVNPTPKTVDALMKLDLPSGVNIEIKL



Statistical distribution of contacts between receptors and ligands in all complexes :
(only contacts < 8A are taken into consideration)


Res_NameRes_NumRes_AtNb_ContactsNb_ComplexesNb[At_Ligand]
LEU83CG111[O],
LEU83CD1311[N], 2[O],
PRO84CG39112[O], 2[P], 19[C], 6[N],
PRO84CD2518[O], 5[N], 12[C],
GLU86CG1315[O], 7[C], 1[N],
GLU86OE21812[N], 10[C], 6[O],
GLU86CD1415[O], 7[C], 2[N],
GLU86OE11215[O], 2[N], 5[C],
ARG87NE111[O],
Total = 9



Download csv file of statistical distribution of contacts