Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MSRHGLLRSLFAAAALLGAAGVFAASAEPLRLEVYNPGEKAIFAVSSELLVGQREAMLIDAQFSRADAEQLVKRIQASGKTLSTIYISHGDPDFYFGLDVLKAAFPEAKILATAQTVAHIQATKDAKLAYWGPILKDNAPTSLVVPEPLKGDQLKLEGHALKVVDLKG-PSPDRTVLWIPSLKTVVGGVLVESGSHVWTADTQTQASRQAWVAMLDRIEALQP--RRVVPGHFTGEEPKGLDGVRFTRDYLKALEAELPKARDSAALVEAMKRRYPNLPGEEGLELSAKVLKGEMQWP |
1KR3 Chain:A ((41-206)) | ------------------------------------------------IVINNHQAALLDTPINDAQTEMLVNWVTDSLHAKVTTFI----PNHWHGDCIGGLGYLQRKGVQSYANQMTIDLAKEKGL----PVPEHGFTDSLTV---------SLDGMPLQCYYLGGGHATDNIVVWLPTENILFGGCMLKDNQATSIGNI-SDADVTAWPKTLDKVKAKFPSARYVVPGHGDYGGTELIEHTKQIVNQYIESTS------------------------------------------ |
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General information:
TITO was launched using:
| RESULT:
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Template: 1KR3.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -59768 for 1291 contacts (-46.3/contact) +
2D Compatibility (PS) -17859 + (NN) -6820 + (LL) 7168
1D Compatibility (HY) -8800 + (ID) 2200
Total energy: -88279.0 ( -68.38 by residue)
QMean score : 0.421
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