Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | -----MIRIG----------TRGSLLATTQAATVRDALIAGGHSAELVTIS-TEGDRSMAPIASLGVGVFTTALREAMEAGLVDAAVHSYKD--LPTAADPRFTVAAIPPRNDPRDAVVARDGL--TLGELPVGSLV-GTSSPRRAAQLRALGLG----LEIRPLRGNLDTRLNKVSSGDLDAIVVARAGLARLGRLDDVTETLEPVQMLPAPA-QGALAVECRAG--DSRLVAVLAELDDADTRAAVTAERALLADLEAGCSAPVGAIAEVVESIDEDGRVFEELSLRGCVAALDGSDVIRASGIGSCGRA---RE-LGLSVAAELFELGARELMWGVRH---- |
3UIF Chain:A ((2-331)) | VEDLKVVRIASVATNVGGKTVYAGSASLVVNGAFPEELRKQGIKVEWVPAAMAS---------------VGPVINEGFASGKIDFGIYGDLPPIILNASKPTVQLVAPWGTTSNSYLVVPKNSTAKSIKDLKGKKIALHRGRPWELAFSNLLQSEGLTFKDFKIVNVNPQVGAAALASGTVDGFFSLFDSYILEDRGVGKIIWSTKTAPVDWKLMGGVWARNDFVKQNPEITQAIVTAYLKSVHWVAQDENKETYIREYSNKIYPESVNRREYDQDNVSWRQRWSPLYDVALQEHYRKAVAYAQASGLTRTQADVQQMLNPHFVATALKELKLEGFWTPNAENLY |
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General information:
TITO was launched using:
| RESULT:
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Template: 3UIF.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -44966 for 2419 contacts (-18.6/contact) +
2D Compatibility (PS) -30932 + (NN) -7256 + (LL) 572
1D Compatibility (HY) 1600 + (ID) 1800
Total energy: -82782.0 ( -34.22 by residue)
QMean score : 0.237
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