Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MKKTIMASSLAVALGVTGYAAGTGHQAHAAEVNVDQAHLVDLAHNHQDQLNAAPIKDGAYDIHFVKDGFQYNFTSNGTTWSWSYEAANGQTAGFSNVAGADYTTSYNQGSDVQSVSYNAQSSNSNVEAVSAPTYHNYSTSTTSSSVRLSNGNTAGATGSSAAQIMAQRTGVSASTWAAIIARESNGQVNAYNPS----G-ASGLFQTMP-GWGPT-------------------NTVDQQINAAVKAYK-AQGLGAWGF |
2GV0 Chain:A ((22-112)) | ------------------------------------------------------------------------------------------------------------------------------------------------------------------------HGYSLGDWVCTAKHESNFNTAATNYNRGDQSTDYGILQINSRWWCNDGKTPKAKNACGIECSELLKADITAAVNCAKRIVRDPNGMGAWVA |
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General information:
TITO was launched using:
| RESULT:
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Template: 2GV0.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -20820 for 400 contacts (-52.0/contact) +
2D Compatibility (PS) -6980 + (NN) -2426 + (LL) 8356
1D Compatibility (HY) -1200 + (ID) 850
Total energy: -23920.0 ( -59.80 by residue)
QMean score : 0.567
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