Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MTEYKLVVVGAGGVGKSALTIQLIQNHFVDEYDPTIEDSYRKQVVIDGETCLLDILDTAGQEEYSAMRDQYMRTGEGFLCVFAINNSKSFADINLYREQIKRVKDSDDVPMVLVGNKCDLPTRTVDTKQAHELAKSYGIPFIETSAKTRQGVEDAFYTLVREIRQYRMKKLNSSDDGTQGCMGLPCVVM
2CE2 Chain:X ((1-165))
MTEYKLVVVGAGGVGKSALTIQLIQNHFVDECDPTIEDSYRKQVVIDGETCLLDILDTAGQEEYSAMRDQYMRTGEGFLCVFAINNTKSFEDIHQYREQIKRVKDSDDVPMVLVGNKSDLAARTVESRQAQDLARSYGIPYIETSAKTRQGVEDAFYTLVREIRQ------------------------
General information:
TITO was launched using:
RESULT:
Template:
2CE2.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -105953 for 1331 contacts (-79.6/contact) +
2D Compatibility (PS) -18664 + (NN) -11679 + (LL) 1020
1D Compatibility (HY) -22000 + (ID) 7500
Total energy: -164776.0 ( -123.80 by residue)
QMean score : 0.589
(partial model without unconserved sides chains):
PDB file :
Tito_2CE2.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-2CE2-query.scw
PDB file :
Tito_Scwrl_2CE2.pdb
: