Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MNTIVMQADKKLQEKIRTDLAQHHISNNNPYVVFSAKISGTTVLLYTSGKLVFQGSNASHIAQKYGYIEQKESCSSETQDIPIIGTDEVGNGSYFGGLAVVASFVTPKDHAYLKKLGVGDSKTLTDQKIKQIAPLLEKAIPHKALLLSPQKYNQVVGPNNKHNAVSVKVALHNQAIFLLLQDGFEPEKIVIDAFTSSKNYQNYLKNEKNQFKQTITLEEKAENKYLAVAVSSIIARNLFLENLNKLSDDVGYKLPSGAGHQSDKVASQLLKAYGISSLEHCAKLHFANTKKAQALLK |
4PY5 Chain:A ((32-266)) | ---------------------------------YRLRLNDAILTVYKSGSVVYGGKGREKLKELVA-----ETVLSDTE-LPRIGCNEAGKGEFVGPLVVACIVADEKCLKRLIELGVKDSKKLSNEKVEELASEITETCHGKVKLLIPEKYNRAY---SKFKNINRLLEAVYREIVSDLCEKFSPKVVVVDKF--SNRAEEVLKDVVKGAR--LEVRPKAEDD-LAVAAASIVAKAVRLKTMKELEKRFKVKLPEG-----NTGLAELLKKTPKELHEKLFKLHFSV--------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 4PY5.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -92514 for 1909 contacts (-48.5/contact) +
2D Compatibility (PS) -25674 + (NN) -13672 + (LL) 4016
1D Compatibility (HY) -15600 + (ID) 3500
Total energy: -146944.0 ( -76.97 by residue)
QMean score : 0.487
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