Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MDFIDEVKLYLKAGDGGDGCVSFRREKFVEFGGPNGGNGGKGGNIVFVSDANLNTLLNFRYRRHVKAGSGKSGASRDRSGTAGKNIVLKVPVGTQIIDEESEKIILDFNKPDMEFLIAQGGKGGLGNTNFKSSINRAPRHFTCGQFGEEKYVVLKLKVLSDVGIIGMPNAGKSKFLTRCSNADTKVGDYPFTTIKPHLGVAKVDNSEVVIVDIPGIITDAHLG--IGLGHKFLKHVERCKILLHLIDVTHDNVVSAYNCMRNELELYNSDLVKKEEIIVLNKCDLLRKV---EIFEKKNHLANYLNKEVLCLSI--GEDLQPILRLLNEKLKKGSSKKVDVYDPFKR |
2WJG Chain:A ((7-170)) | --------------------------------------------------------------------------------------------------------------------------------------------------------------SYEIALIGNPNVGKSTIFNALTGENVYIGNWPGVTVEKKEGEFEYNGEKFKVVDLPGVYSLTANSIDEIIARDY-IINEKPDLVVNIVDATALE---RNLYLTLQLME-----MGANLLLALNKMDLAKSLGIEIDVDKLE---KILGVKVVPLSAAKKMGIEELKKAISIAVKDK------------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 2WJG.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -75918 for 1231 contacts (-61.7/contact) +
2D Compatibility (PS) -17185 + (NN) -8191 + (LL) 7700
1D Compatibility (HY) -9200 + (ID) 1500
Total energy: -104294.0 ( -84.72 by residue)
QMean score : 0.518
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