Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MRCSTKEMRLVYRDFLLQANQENKQITVLEADLSSSMSTNVLASEFGKRYINLGIMEAEMVGLAAGLAIKGYK-PYLHTFGPFASRRVFDQVFLSLGYSQLSATIIGSDAGVSAEMNGGTHMPFEELGLLRLIPKATIFEVSDDIQFEAILKQTLSIDGLKYIRTIRKAPTAVYEGCEDFSKGFIQ-LRQGKD--IALVASGIMVSRAIEAADYLKELGIEASVIDLFKIKPLPEELKPLLIDQS------IVTIENHNRIGGIGSALCEWLSMEKDTTVSRMGIDERFGQVGQMKYLLEEYGLAVKDIVEHCKSIYKS |
4KXW Chain:A ((318-607)) | --------RKAYGQALAKLGHASDRIIALDGDTKNSTFSEIFKKEHPDRFIECYIAEQNMVSIAVGCATRNRTVPFCSTFAAFFTR-AFDQIRMA-AISESNINLCGSHCGVSIGEDGPSQMALEDLAMFRSVPTSTVFYPSDGVATEKAVELAANTKGICFIRTSRPENAIIYNNNEDFQVGQAKVVLKSKDDQVTVIGAGVTLHEALAAAELLKKEKINIRVLDPFTIKPLDRK---LILDSARATKGRILTVEDHYYEGGIGEAVSSAVVGEPGITVTHLAVN-RVPRSGKPAELLKMFGIDRDAIAQAVRGLITK |
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General information:
TITO was launched using:
| RESULT:
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Template: 4KXW.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -177113 for 2524 contacts (-70.2/contact) +
2D Compatibility (PS) -30611 + (NN) -13153 + (LL) 1244
1D Compatibility (HY) -15200 + (ID) 4350
Total energy: -239183.0 ( -94.76 by residue)
QMean score : 0.487
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