Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MAFIPFKKSNKCVVTDELFLEVTWEDGKPPEDDSELLGIIEGLEQQYLDSFQHSIEESLPYMTFQQAELLFQSLKDAYGHFQLKKVAICHLEGKQAVSEGEVFASPFIIDSRYQNLLLPLIQSIMIGPDFQSYTYQEKREYFVNQIYPAYKVSLGIQESALPLFPEEGEQIPLDNTFVANRRVASIPTTSSEPRKPNSSFSLKKVYLLMGFLATLAAGAMVSSVSLHAELSKQQEQVNYLYQEWKDIQNLSDKEHQIDVFSRYFLPNYYSGKK-------ENLSDFLSDGDAKYT-VPKEGSLQSVILEKVTYDAKTKHYQLTYVLTIK-----AK-------EQLTSVRLEFEVKEQPSRKYGYVVTSEPKETPYLMKN |
3UB1 Chain:A ((6-135)) | -----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------SLETQAFSFAEEFAWDYFSRYPSDTQDFVRRITKYTTEQLANEMNNGTYSDVIYTSAFYFEKYS-ENQVNVSVKARVRVYTPKAGQEQDQLQYDTNLVDYYLEVPIVFDKDMNMAVDALPVMTAPPEKA |
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General information:
TITO was launched using:
| RESULT:
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Template: 3UB1.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -27254 for 721 contacts (-37.8/contact) +
2D Compatibility (PS) -11007 + (NN) 4680 + (LL) 18544
1D Compatibility (HY) -400 + (ID) 750
Total energy: -16187.0 ( -22.45 by residue)
QMean score : 0.453
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