Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MKSFCVKAPAKINLFLHVVEKKETGYHLIEGLFVFANLSNFLEIKVGEKDFRYDNPIVEFVNSELKISNKYNTVMRAVNLLLRHAPVRTKVTVKVVKNIPTSAGLGSGSSDAGAVIRTLGKLWKIDRPI--LNEIALSVGADVPASIDSKPVLVRGIGEELCYI---NKFSLPTNIVLAKPKKKFLST--------------PEVFSKYGGNFSKPIEWRDDTEKDLLKLLKETENDLQEIAISLVPEIRDVILALESQEGSILSRMSGSGVTCFGIFDSEENAKTAAVNIREKQPEWWVCDAQLIV |
3PYG Chain:A ((5-271)) | --SVTVRVPGKVNLYLAVGDRREDGYH--ELTTVFHAVSLVDEVTVRNADVLSLELVGE--GADQLPTDERNLAWQAAELMAEHVGRAPDVSIMIDKSIPVAGGMAGGSADAAAVLVAMNSLWELNVPRRDLRMLAARLGSDVPFALHGGTALGTGRGEELATVLSRNTF----HWVLAFADSGLLTSAVYNELDRLREVGDPPRLGEPGPVLAALAAGDPDQLAPLLG------NEMQAAAVSLDPALARALRA-GVEAGALAGIVSGSGPTCAFLCTSASSAIDVGAQLSGAGVCRTVRVATGPV |
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General information:
TITO was launched using:
| RESULT:
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Template: 3PYG.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -92555 for 2086 contacts (-44.4/contact) +
2D Compatibility (PS) -26685 + (NN) -2083 + (LL) 1888
1D Compatibility (HY) -10000 + (ID) 3850
Total energy: -133285.0 ( -63.90 by residue)
QMean score : 0.338
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