Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MDLQQIDELENKFEEQEEQAQDTPLKQEPSTKEVKIPKKRGRKKSLLDEDKKKSFNIAFSPCVIKELNEFLLEFGSFKETRSTFIEEALIRHLKHRKNTQEQKLLKQLERLQNKEKGIMKTMNLNEFFTHKIIYKDTPLKFKDTLEQEISQASLVEKLILANILANMVFAKISNENAPKILISRLMCKFSPIDYESTIPSDFKPIDEEEYEDDLEWLNEEKEDRLFNYYLFLNGIKESDVEEVFNESVEIYDECLIEIAQNVLKDKFSYDIDLLQVLVKGYAKEIREFLSYKPIKEIKDFKDKDTALYISLGKDYDKEKEPFSKKLQQCFKEILESKGI |
2KEL Chain:A ((12-55)) | --------------------------------------------------QKAVFGIYMDKDLKTRLKVYCAKNN---LQLTQAIEEAIKEYLQKRNG------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 2KEL.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -5964 for 203 contacts (-29.4/contact) +
2D Compatibility (PS) -4765 + (NN) -2043 + (LL) 22256
1D Compatibility (HY) -1600 + (ID) 500
Total energy: 7384.0 ( 36.37 by residue)
QMean score : 0.716
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