Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MSQEEHNHEELNDQLQVRRDKMNQLRDNGIDPFGARFERTHQSQEVISAYQDLTKEELEEKAIEVTIAGRMMTKRGKGKAGFAHLQDLEGQIQIYVRKDSVGDDQYEIFKSSDLGDLIGVTGKVFKTNVGELSVKATSFELLTKALRPLPDKYHGLKDVEQRYRQRYLDLIVNPDSKHTFITRSKIIQAMRRYLDDHGYLEVETPTM--------HSIPGGASARPFITHHNALDIPLYMRIAIELHLKRLIVGGLEKVYEIGRVFRNEGVSTRHNPEFTMIELYEAYADYKDIMSLTENLVAHI--AQEVLGTTTIQYGEEQIDLKP-EWKRIHMVDAVKEATGVDFWEEVTVEQAREYAKEHEVEIKDSMTV-GHIINEFFEQKIEETLIQPTFIYGHPVEISPLAKKNPEDPRFTDRFELFIVGREHANAFTELNDPIDQRERFEAQLKEREAGNDEAHLMDEDFVEALEYGMPPTGGLGIGIDRLVMLLTNAPSIRDVLLFPQMRQR |
3G1Z Chain:A ((16-321)) | ----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------NLLKRAAIMAEIRRFFADRGVLEVETPCMSQATVTDIHLFPFETR---FVG---SQGINLYLMTSPEYHMKRLLAAGCGPVFQLCRSFRNEEMGRHHNPEFTMLEWYRPHYDMYRLMNEVDDLLQQVLDCQPAESLSYQQAFQRHLEIDPLSADKTQLREA---AAKLDLSNIADTEEDRDTL----LQLLFTMGVEPHIGKE-----------KPTFIYHFPASQASLAQISTEDHRVAERFEVYYKGIELANGFHELTDAREQQQRFEQDNRKRAAR-LPQQPIDQNLLDALAAGLPDCSGVALGVDRLVMLALGAESLADVIAF------ |
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General information:
TITO was launched using:
| RESULT:
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Template: 3G1Z.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -88825 for 2224 contacts (-39.9/contact) +
2D Compatibility (PS) -30830 + (NN) -8540 + (LL) 14276
1D Compatibility (HY) -19600 + (ID) 5100
Total energy: -138619.0 ( -62.33 by residue)
QMean score : 0.409
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