Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MNKQIQTEADELGFFGEYGGQYVPETLMPAIIELKKAYKEAKADPEFQRELEYYLSEYVGRATPLTYAASYTESLGG-AKIYLKREDLNHTGAHKINNALGQALLAKRMGKKKLVAETGAGQHGVASATVAALFDMELVVFMGSEDIKRQQLNVFRMELLGAKVVA-----VEEGQ----------GTLSDAVNKALQYWVSHVDDTHYLLGSALGPDPFPTIVRDFQSVIGKEIKSQILKKEGRLPDAIVACIGGGSNAIGTFYPFIKDDVALYGVE----AAGQGEDTDKHALAIGK----GSPGVLHGTKMYLIQDEGGQVQLAHSISAGLDYPGIGPEHSYYHDIGRVTFENASDTQAMNALINFTKHEGIIPAIESAHALSYVERLAPTMSK---EDIIVVTISGRGDKDMETIRQYMAERGLAND |
4QYS Chain:B ((45-419)) | ------------------------EVLPSKVLELEFAKERYVKIPD--EVLERYLQ--VGRPTPIIRAKRLEEYLGNNIKIYLKMESYTYTGSHKINSALAHVYYAKLDNAKFVTTETGAGQWGSSVALASALFRMKAHIFMVRTSYYAKPYRKYMMQMYGAEVHPSPSDLTEFGRQLLAKDSNHPGSLGIAISDAVEY--AHKNGGKYVVGSVVNSDIM------FKTIAGMEAKKQ-MELIGEDPDYIIGVVGGGSNYAALAYPFLGDELRSGKVRRKYIASGSSE-VPKMTKGVYKYDYPDTAKLLPMLKMYTI---GSDFVPPPVYAGGLRYHGVAPTLSLLISKGIVQARDYSQEESFKWAKLFSELEGYIPAPETSHALPILAEIAEEAKKSGERKTVLVSFSGHGLLDL--------------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 4QYS.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -90670 for 3212 contacts (-28.2/contact) +
2D Compatibility (PS) -37506 + (NN) -10344 + (LL) 3800
1D Compatibility (HY) -20000 + (ID) 6100
Total energy: -160820.0 ( -50.07 by residue)
QMean score : 0.418
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