Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MSDYLVKALAYDGMARVYAAVTTETIKEAQRRHDTWSVSSAALGRTMTGTLFLGAMQKEDQKITVKIEGDGPIGPIVADSNAQGQIRGYVTNPHVHFSELNEAGKLDVRRGVGTSGMLSVVKDLGFGENFTGQTPIVSGEIGEDFTYYLATSEQINSSVGVGVLVNPDDTIEAAGGFMLQLLPGATDEIIDEIEKNLMALPTVSRMIEAGE----TPESILAKLAGGEDKLQILEKIPVSFECNCSKERFGSAIISLGKEEIRSMIEEDHGAEAECHFCRNTYDFSEEELKTLYEEAK |
1HW7 Chain:A ((7-234)) | --DQLHRYLFENFAVRGELVTVSETLQQILENHDYPQPVKNVLAELLVATSLLTATLKFDGDITVQLQGDGPMNLAVINGNNNQQMRGVA---RVQ-GEIPENA--DLKTLVG-NGYVVITITPSEGERYQGVVGLEGDTLAACLEDYFMRSEQLPTRLFIR--TGDVDGKPAAGGMLLQVMPAQNAQ-----QDDFDHLATLTETIKTEELLTLPANEVLWRLY-HEEEVTVYDPQDVEFKCTC----------------------------------------------------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 1HW7.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -63797 for 1582 contacts (-40.3/contact) +
2D Compatibility (PS) -23608 + (NN) -5221 + (LL) 5200
1D Compatibility (HY) -10400 + (ID) 2950
Total energy: -100776.0 ( -63.70 by residue)
QMean score : 0.331
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