Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MINKDSLTHHISQQFNAELEDVRSHLLAMGGLVEKQVNDAVNALIDADSGLAQQVREIDDQINQMERNIDEECVRILARRQPAASDLRLIISISKSVIDLERIGDEASKVARRAIQLCEEGESPRGYVEVRHIGSQVQKMVQEALDAFARFDADLALSVAQYDKTVDREYKTALRELVTYMME---DPRAISRVLNIIWALRSLERIGDHARNIAELVIYLVRGTDVRHIGLTRMKEEVENNRGE |
1XWM Chain:A ((12-107)) | -----------------------------------------------------------------------------------------------------------------------------LHNKLIEMGRLTEVALQQAIEAFQTQNANLAMAVIDGDGSIDALEEEVNDFALWLIAAQQPVATDLRRIVAAIKIASDIERIADFAVNIAKACIRI------------------------ |
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General information:
TITO was launched using:
| RESULT:
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Template: 1XWM.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -44429 for 634 contacts (-70.1/contact) +
2D Compatibility (PS) -10251 + (NN) -5134 + (LL) 11468
1D Compatibility (HY) -2800 + (ID) 1100
Total energy: -52246.0 ( -82.41 by residue)
QMean score : 0.533
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