Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MKRTLVLLITAIFILAACGNHKDDQAGKDNQKHNNSSNQVKEIATDKNVQGDNYRTLLPFKESQARGLLQDNMANSYNGGDFEDGLLNLSKEVFPTDKYLYQDGQFLDKKTINAYLNPKYTKREIDKMSEKDKKDKKANENL--GLNPSHEGETNPEKIAEKSPAYLSNILEQDFYGGGDTK-GKNIKGMTIGLAMNSVYYYKKEKDGPTFSKKLDDSEVKKQGKQMASEILSRLRENDDLKDIPIHFAIYKQSSEDSITPGEFITQATAEKSQTKLNEWHNINEKSALLPSSTAADYDENLNNNFKQFNDNLQSYFSNFTQAVGKVKFVDKKPQRLVVDLPIDYYGQAETIGITQYVTEQANKYFDKIDNYEIRIKDGNQPRALISKTKDDKEPQVHIYSN |
4UN1 Chain:B ((21-179)) | ------------------------------------------------------------------------------------------------------------------------------MSHQFSPEEQAVLRIVQANLPDSLTPYADLAEQAGMTEAQVLELLGRLKASGAIRRFGASIKHQKTGWTHNAMVAWK------VTPDQVDDCGRKAAEHSHISHVYYRPSSAPDWPY-EMYTMIHGRSEAECLGVVEDVKRTTSLKEHAILRSLKELKKTSMTYFT-------------------------------------------------------------------------------------------------------------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 4UN1.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) 62683 for 967 contacts (64.8/contact) +
2D Compatibility (PS) -15987 + (NN) 3019 + (LL) 12720
1D Compatibility (HY) -2000 + (ID) 1250
Total energy: 59185.0 ( 61.20 by residue)
QMean score : 0.193
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