Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MLTQEQDQQLVERVQRGDKRAFDLLVLKYQHKILGLIVRFVHDAQEAQDVAQEAFIKAYRALGNFRGDSAFYTWLYRIAINTAKNHLVARGRRPPDSDVTAEDAEFFEGDHALKDIESPERAMLRDEIEATVHQTIQQLPEDLRTALTLREFEGLSYEDIATVMQCPVGTVRSRIFRAREAIDKALQPLLREA |
3HUG Chain:A ((19-90)) | -----------------------------------------------------------------------------------------------------------------------PDEVNAALDRLLIADALAQLSAEHRAVIQRSYYRGWSTAQIATDLGIAEGTVKSRLHYAVRALRLTLQELGVTR |
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General information:
TITO was launched using:
| RESULT:
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Template: 3HUG.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -30132 for 453 contacts (-66.5/contact) +
2D Compatibility (PS) -7821 + (NN) -2068 + (LL) 9436
1D Compatibility (HY) -2400 + (ID) 900
Total energy: -33885.0 ( -74.80 by residue)
QMean score : 0.857
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