Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MALAKIVYASMTGNTEEIADIVADKLRDLGLDVEVEECTMVDAAD-FEDADIAIVATYTYGDG--DLPDEIVDFYEDLAEVDLSGKVYGVVGSGDTFYDYFCKSVDEFEAQFALTGAQKGADCVKVDLAAEDEDIENLEAFAEEIASKLN
1WSB Chain:A ((2-127))
-AKALIVYGSTTGNTEYTAETIARELADAGYEVDSRDAASVEAGGLFEGFDLVLLGCSTWGDDCIELQDDFIPLFDSLEETGAQGRKVACFGCGDSSYEYFCGAVDAIEEKLKNLGAEIVQDGLRIDGDPRAARDDIVGWAHDVRGAI--
General information:
TITO was launched using:
RESULT:
Template:
1WSB.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -72062 for 1002 contacts (-71.9/contact) +
2D Compatibility (PS) -13436 + (NN) -5690 + (LL) 528
1D Compatibility (HY) -6400 + (ID) 2200
Total energy: -99260.0 ( -99.06 by residue)
QMean score : 0.582
(partial model without unconserved sides chains):
PDB file :
Tito_1WSB.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-1WSB-query.scw
PDB file :
Tito_Scwrl_1WSB.pdb
: