Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MRPLVATVDLSAIRHNY-ALAKRCAPQRQAFAVVKANAYGHGAREVVTALHD-DADGFAVACLEEAAEVRALHASARILLL-----EGCFEASEYALAGQL---RLDLVIQGAEQGEAFLAAGLDIPLNVWLKLDSGMHRLGFDPAALRAWHARLRSHPGVRELNLISHFACAD---ERNHPLTEQQLESFLGLLD------LDFDQRSLANSAAVLTIPAAHMDWLRPGIMLYGS-TPLADLSAAELGLKPAMSLGAQLISLREVAVGESVGYGATWIAERPARIGTVSCGYADGYPRTAPAGTP-VLVGGRRAILAGRVSMDMLAVDLSDLPEARVGDPVELWGAG----LSVDEVARACGTLGYELLSKVTARVPRRYSH |
4ECL Chain:A ((11-368)) | -------INLNNLEHNVNTLQKAMSPKCELMAVVKAEAYGHGMYEVTTYLEQIGVSSFAVATIDEGIRLRKYGISSEILILGYTSPSRAKELCKYELTQTLIDYRYSLLLN---------KQGYDIKAHI--KIDTGMHRLGFSTEDKDKILAAF-SLKHIKVAGIFTHLCAADSLEENDVAFTNKQIGSFYKVLDWLKSSGLNIPKVHIQSSYGLLNYPELECDYIRVGVALYGVLSSTNDKTKLELDLRPVLSLKAKVVLIRKIKQGESVGYSRAFTATRDSLIAILPIGYADGFPRNLSCGNSYVLIGGRQAPIVGKICMDQLAVDVTDIPNVKTGSIATLIGKDGKEEITAPMVAESAESITNELLSRMGHRL------ |
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General information:
TITO was launched using:
| RESULT:
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Template: 4ECL.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -208948 for 2744 contacts (-76.1/contact) +
2D Compatibility (PS) -35093 + (NN) -7189 + (LL) 1912
1D Compatibility (HY) -29600 + (ID) 6050
Total energy: -284968.0 ( -103.85 by residue)
QMean score : 0.432
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