Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MSNINLKPEEVGVYAIGGLGEIGKNTYGIEYQDEIIIVDAGIKFPEDDLLGIDYVIPDYSYIVENIDRIKALVITHGHEDHIGGIPFLLKQA--NLPIYAGPLALALIKGKLEEHGLL---------RDATLYEIHANTELTFKNLSVTFFRTTHSIPEPLSIVIHTPQGKVICTGDFKFDFTPVGEPADLHRMAALGEDGVLCLLSDSTNAEVPTFTN--SEKIVGQSIMKIIEGIDGRIIFASFASNIFRLQQAAEAAVKTG--------RKIAVFGRSMEKAIVNGIELGYIKVPKGTFIE---PSELKN-LHASEVLIMCT-GS--QGESMAALARIANGTHRQVTLQPGDTVIFSSSPIPGNTTSVN-KLINTIQ-EAGVDVIH-GKINNIHTSGHGGQQEQKLMLRLIKPKYFMPVHGEYRMQKVHAG-LAVDTGIP---KENIFIMENGDVLALTSDSARIAGHFNAQDIYVDGNGIGDIGAAVLRDRHDLSEDGVVLAVATVDFDSKMILAGPDILSRGFIYMRESGDLIRESQHILFNAIRIALKNKDASIQSVNGAIVNALRPFLYEKTEREPIIIPMVLTPDK |
2I7T Chain:A ((9-458)) | -------SDQLLIRPLGAGQEVGRSCIILEFKGRKIMLDCGIHPGLE---GM-DALPYIDL--IDPAEIDLLLISHFHLDHCGALPWFLQKTSFKGRTFMTHATKAIYRWLLSDYVK-LYTETDLEESMDKIETINFHEVKEVAGIKFWCYHAGH-VLGAAMFMIEIAGVKLLYTGDFSRQ--------MAA---EIPNIKPDILIIESTYGTHIHEKREEREARFCNTVHDIVNR-GGRGLIPVFA--LGRAQELLLILDEYWQNHPELHDIPIYYA-----------------------FKHISNLKSMDHFDDIGPSVVMASPGMMQSGLSRELFESW--------CTDKRNGVIIAGYCVEGTLAKHIMSEPEEITTMSGQKLPLKMSVDYISFSAHTDYQQTSEFIRALKPPHVILVHGEQNEMARLKAALIREYEDNDEVHIEVHNPRNTEAVTLNFR---------------------------------------------------------------------------------------------------------------------------------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 2I7T.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -196488 for 3171 contacts (-62.0/contact) +
2D Compatibility (PS) -40927 + (NN) -20087 + (LL) 12236
1D Compatibility (HY) -12400 + (ID) 3300
Total energy: -260966.0 ( -82.30 by residue)
QMean score : 0.427
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