Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MNTPLYKALIQHARRNSHSFHVPGHHNGDVFFDDAKSIFDPLLTIDVTELAGLDDLHHPSGVIKEAQELASQLYGSAESFFLVNGTTVGNLAMILSVCEPGDTILVQRNCHKSVFHAVDLSGAEPVYLAPDVDSAMHVPTHVPLGTIKEALEAYPDAKGLVLTNPTYYGHSADLTEIITEAHHYGIPVLVDEAHGAHFILGEPFPVSALKMGADIVVQSAHKTLPAMTMGS--YLHLNSSCRINRDRVAEYLNRLQSSSPSYPIMASLDIARAYVQHIIEEQKLSDILQRIETLK-QTFDSLTNAEAVNPANPLIITDPLKLTIRSKRGHSGYTLQSILERANIFTELADENQVLLVLPLGGKRRINAEIIRSIDEEIEKTPPDQTFVSAEWGVQPVTVLP--YPKKVLHSFKKEYVSF---EEAAGRLNAEDIIPYPPGIPMIMAGERITKESVQKLSRLISMKTHVQGNMKIKEKQLLVYIEEEKS |
2X3L Chain:B ((5-443)) | ---PILNKLESLNQEEAISLHVPGHKNMTIGHLSQLS-----MTMDKTEIPGLDDLHHPEEVILKSMKQVEK-HSDYDGYFLVNGTTSGILSVIQSFSQKKGDILMARNVHKSVLHALDISQQEGHFIETHQSPLTNHYNKVNL------------HKLVVLTYPNYYGETFNVEEVIKSLHQLNIPVLIDEAHGAHFGL-QGFPDSTLNYQADYVVQSFHKTLPALTMGSVLYIHKNAPYREN---IIEYLSYFQTSSPSYLIMASLESAAQFYKTYDSTLFFAKRAQLIECLENKGFEMLQ------------VDDPLKLLIKYE-GFTGHDIQNWFMNAHIYLELADDYQALAILPLW--HHDDTYLFDSLLRKIEDMILPKKSV------QLLTTEGNYKPK---------YVTWCDLKKAKGKVLARHIVPYPPGIPIIFKGETITENMIELVNEYLETGMIVEG---IKNNKILV------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 2X3L.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -190575 for 3500 contacts (-54.5/contact) +
2D Compatibility (PS) -44744 + (NN) -11747 + (LL) 3924
1D Compatibility (HY) -34800 + (ID) 8600
Total energy: -286542.0 ( -81.87 by residue)
QMean score : 0.424
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