Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MTVSKVAIASDHGGIELRKSIISYLESVGISYEEF-----GPETPESVDYPRLAITVSEKVVNQEVDRGILVCGTGIGMSIAANKVKGIRCALVGDTFSAHATREHNDTNVLALGARVIGPGLAEDIVKIWLETEYEG-GRHANRVGQITAYEDSHA
3K7S Chain:A ((24-172))
----RVAIGTDHPAFAIHENLILYVKEAG---DEFVPVYCGPKTAESVDYPDFASRVAEMVARKEVEFGVLACGSGIGMSIAANKVPGVRAALCHDHYTAAMSRIHNDANIVCVGERTTGVEVIREIIITFLQTPFSGEERHVRRIEKIRAIEASH-
General information:
TITO was launched using:
RESULT:
Template:
3K7S.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -106913 for 1187 contacts (-90.1/contact) +
2D Compatibility (PS) -15183 + (NN) -3463 + (LL) 836
1D Compatibility (HY) -12000 + (ID) 3300
Total energy: -140023.0 ( -117.96 by residue)
QMean score : 0.550
(partial model without unconserved sides chains):
PDB file :
Tito_3K7S.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-3K7S-query.scw
PDB file :
Tito_Scwrl_3K7S.pdb
: