Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MDRISTETELNWEFVESLNENALSDLEERLEIGFSDAFKDFIKRSNYGFSQLR--------YFMVGNESYMFKHVLNFNLESLLIDFMQSLKEWLEPEEIVFANDGYGGYYLWNTTTDVVLFLDTDNGSKKVLLNLNMFLKKLESRG |
1IJA Chain:A ((64-96)) | ----------------------------------------FIDRPNYQFTNLKAAKKGSMVYFKVGNETRKYKMTSIRDVKPTDVGVLDEQKGKDKQLTLITCDDYNEKTGVWEKRKIFVATEVK---------------------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 1IJA.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -4369 for 82 contacts (-53.3/contact) +
2D Compatibility (PS) -2722 + (NN) 337 + (LL) 5124
1D Compatibility (HY) -2400 + (ID) 700
Total energy: -4730.0 ( -57.68 by residue)
QMean score : -0.027
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