Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MLDKNQLAKYKQDHLCEYEKIMSNNEKEALEEKVASLDLDFIAKLYNDLYINKKTIDDVSAVSEVKYDIKSQMSDDEIKRLEEQGLQAIKEGQFAVLLMAGGQGTRLGYKGPKGSFEIE---GVSLFELQANQL--------KTLNHQSGHTIQWYIMTSDINHEETLAYFEAHSYFGYDQEAIHFFKQDNIVALSEEG-KLILNQQGRIMETPNGNGGVFKSLDKAGYLEEMSNNGVKYIFLNNIDNVLVKVLDPLFAGFTVEHDYDITSKTIQPK-PGESVGRLV--NVDCKDTVLEYSELDPEVANQ----------FNNANIGIHAFKLGFILNAV------NRELPYHLAIKNLKQLDENFGVIEQPT----LKFELFYFDIFTYG--TSFVTLQVPREEEFSPLKNKEG-KDSVATATEDLRRMGLI |
2YQS Chain:A ((83-436)) | ------------------------------------------------------------------------LSKDILQNWTELGLKAIGNGEVAVLLMAGGQGTRLGSSAPKGCFNIELPSQKSLFQIQAEKILKIEQLAQQYLKSTKKPIINWYIMTSGPTRNATESFFIENNYFGLNSHQVIFFNQGTLPCFNLQGNKILLELKNSICQSPDGNGGLYKALKDNGILDDLNSKGIKHIHMYCVDNCLVKVADPIFIGFAIAKKFDLATKVVRKRDANESVGLIVLDQDNQKPCVIEYSEISQELANKKDPQDSSKLFLRAANIVNHYYSVEFLNKMIPKWISSQKYLPFHIAKKKIPSLN---GEFYKPTEPNGIKLEQFIFDVFPSVELNKFGCLEVDRLDEFSPLKNADGAKNDTPTTCRN------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 2YQS.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -104923 for 2458 contacts (-42.7/contact) +
2D Compatibility (PS) -34738 + (NN) -18366 + (LL) 6668
1D Compatibility (HY) -29600 + (ID) 6300
Total energy: -187259.0 ( -76.18 by residue)
QMean score : 0.451
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