Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MSKVLEAKQSAVEEIKTKLSASASTVIVDYRGLNVGEITDLRKQLRDAGIEFKVYKNSLTRRAVEANGYEGLEGALTGPNAIAFSNE---DVVAPAKILNDFAKDH-----EALEIKA---GVIEGKVASLEEIKALATLPSREGLLSMLCNVLQAPVRGLAIATKAVADQKEGQEA |
3IR1 Chain:A ((6-103)) | -------------------------------GTTVGDFGDMVKEQIQPELEKKGY----TVKLVEFTDY-------VRPNLALAEGELDINVFQHKPYLDDFKKEHNLDITEVFQVPTAPLGLYPGKLKSLEEVKDGSTV------------------------------------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 3IR1.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -3748 for 464 contacts (-8.1/contact) +
2D Compatibility (PS) -8979 + (NN) 2587 + (LL) 6404
1D Compatibility (HY) -5200 + (ID) 1550
Total energy: -10486.0 ( -22.60 by residue)
QMean score : 0.162
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