Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | ---MEKLVIGSRGSELALWQANHIKERLKKECSMESEIRI--VKTTGDKILDAPLNKIGGK-GLFTKELEELLLKGAIDLAVHSLKDVPVVFEKGLDLACITKRADVRDTFLSVK----FPDLMSLPKGAKVG---TTSLRRSMQIKFKRKDLDTESLRG---NVQTRLKKLECGEFDAIILAEAGLCRLNVQGAKYRKAFSVKEMIPSM-GQGALGVEMLK-NHKHFITLQKLNNEESAFCCHLEREFIKGLNG--GCQIPIGVHANLMGDEVKIRAVLGLPNGKEVIAKEKQ-GDKTKAFDLVQELLE-------EFLQSGAKEILEK-------AQLF |
3UIF Chain:A ((2-331)) | VEDLKVVRIASVATNVGGKTVYAGSASLVVNGAFPEELRKQGIKVEWVPA----------AMASVGPVINEGFASGKIDFGIYGDLPPIILNASKPTVQLVAPWGTTSNSYLVVPKNSTAKSIKDL-KGKKIALHRGRPWELAFSNLLQSEGLTFKDFKIVNVNPQVGAAALASGTVDGFFSLFDSYILEDRGVGKIIWSTKTAPVDWKLMGGVWARNDFVKQNPEITQAIVTAYLKSVHWVAQDENKETYIREYSNKIYPESVNRREYDQDNVSWRQRWSPLYDVALQEHYRKAVAYAQASGLTRTQADVQQMLNPHFVATALKELKLEGFWTPNAENLY |
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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) -11669 for 2409 contacts (-4.8/contact) +
2D Compatibility (PS) -30576 + (NN) -4458 + (LL) -16
1D Compatibility (HY) -2800 + (ID) 1800
Total energy: -51319.0 ( -21.30 by residue)
QMean score : 0.240
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