Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MSQSLFSLAFGVGTQNRQEAWLEVFYALPLLKPSSEIVAAVAPILGYAAGNQALTFTSQQAYQLADALKGIDAAQSALLSRLAESQKPLVATLLAEDAAPSSTAEAYLKLHLLSHRLVKPHAVNLSGIFPLLPNVAWTNIGAVDLAELAELQLEARLKGKLLEVFSVDKFPKMTDYVVPAGVRIADTARVRLGAYIGEGTTVMHEGFVNFNAGTEGPGMIEGRVSAGVFVGKGSDLGGGCSTMGTLSGGGNIVISVGEGCLIGANAGIGIPLGDRNIVEAGLYITAGTKVALLDEQNALVKVVKARDLAGQPDLLFRRNSQNGAVEC-KTNKTAIELNEALHAHN |
3FSY Chain:E ((86-312)) | --------------------------------------------------------------------------------------------------------DAYLRLHLLSHRLVAPHGLNAGGLFGVLTNVVWTNHGPCAIDGFEAVRARLRRRGPV-TVYGVDKFPRMVDYVVPTGVRIADADRVRLGAHLAPGTTVMHEGFVNYNAGTLGASMVEGRISAGVVVGDGSDVGGGASIMGTL-----HVISIGKRCLLGANSGLGISLGDDCVVEAGLYVTAGTRVTMPDSNS-----VKARELSGSSNLLFRRNSVSGAVEVLARDGQGIAL-------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 3FSY.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -138646 for 1780 contacts (-77.9/contact) +
2D Compatibility (PS) -24297 + (NN) -15398 + (LL) 9392
1D Compatibility (HY) -25200 + (ID) 6650
Total energy: -200799.0 ( -112.81 by residue)
QMean score : 0.494
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