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 :C4_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 C4_S1
Complex: SRT_A_6(3CK2) / Model_31(3CK2/A) = [3.2] Download643.204.38MAKQTIIVMSDSHGDSLIVEEVRDRYVGKVDAVFHNGDSELRPDSPLWEGIRVVKGNMDFYAGYPERLVTELGSTKIIQTHGHLFDINFNFQKLDYWAQEEEAAICLYGHLHVPSAWMEGKILFLNPGSISQPRGTIRECLYARVEIDDSYFKVDFLTRDHEVYPGLSKEFSR
Consensus
[pKd Mean = 3.20]		-643
(s=0)		4
(s=0)		MAKQTIIVMSDSHGDSLIVEEVRDRYVGKVDAVFHNGDSELRPDSPLWEGIRVVKGNMDFYAGYPERLVTELGSTKIIQTHGHLFDINFNFQKLDYWAQEEEAAICLYGHLHVPSAWMEGKILFLNPGSISQPRGTIRECLYARVEIDDSYFKVDFLTRDHEVYPGLSKEFSR



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]
ARG144NE211[C], 1[O],
ARG144CZ613[C], 3[O],
GLU146OE1312[O], 1[C],
LYS153CG713[C], 4[O],
LYS153CE1016[O], 4[C],
LYS153CD713[C], 4[O],
LYS153NZ1016[O], 4[C],
ASP155CG1014[C], 6[O],
ASP155OD21016[O], 4[C],
ASP155OD11016[O], 4[C],
LEU157CD1212[O],
VAL163CG11014[C], 6[O],
VAL163CG21016[O], 4[C],
PRO165CD111[O],
PRO165CG111[O],
SER168OG1014[C], 6[O],
GLU170CG111[O],
GLU170CD111[O],
GLU170OE1111[O],
GLU170OE2111[O],
Total = 20



Download csv file of statistical distribution of contacts