Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MALAKIVYASMTGNTEEIADIVADKLRDLGLDVEVEECTMVDAAD-FEDADIAIVATYTYGDG--DLPDEIVDFYEDLAEVDLSGKVYGVVGSGDTFYDYFCKSVDEFEAQFALTGAQKGADCVKVDLAAEDEDIENLEAFAEEIASKLN
1WSW Chain:A ((2-127))
-AKALIVYGSTTGNTEYTAETIARELADAGYEVDSRDAASVEAGGLFEGFDLVLLGCSTWGDDCIELQDDFIPLFDSLEETGAQGRKVACFGCGDSSYEYFCGAVDAIEEKLKNLGAEIVQDGLRIDGDPRAARDDIVGWAHDVRGAI--
General information:
TITO was launched using:
RESULT:
Template:
1WSW.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -76117 for 1012 contacts (-75.2/contact) +
2D Compatibility (PS) -13393 + (NN) -5788 + (LL) 528
1D Compatibility (HY) -6400 + (ID) 2200
Total energy: -103370.0 ( -102.14 by residue)
QMean score : 0.633
(partial model without unconserved sides chains):
PDB file :
Tito_1WSW.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-1WSW-query.scw
PDB file :
Tito_Scwrl_1WSW.pdb
: