Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MRKRMVIGLSTGSDDDDVEVIGGVDPRLIAVQENDSDESSLTDLVEQPAKVMRIGTMIKQLLEEVRAAPL----DEASRNRLR-DIHATSIRELEDG---LAPELREELDRLTLPFNEDAVPSDAELRIAQAQLVGWLEGLFHGIQTALFAQQMAARAQLQQMRQGALPPGVGKSGQHGHGTGQYL |
3REQ Chain:A ((616-677)) | -----------------------------------------------------IATAYADLGFDVDVGPLFQTPEETARQAVEADVHVVGVSSLAGGHLTLVPALRKELDKLGRP----------------------------------------------------------------------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 3REQ.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) 1642 for 269 contacts (6.1/contact) +
2D Compatibility (PS) -5762 + (NN) -544 + (LL) 7760
1D Compatibility (HY) -4000 + (ID) 1050
Total energy: -1954.0 ( -7.26 by residue)
QMean score : 0.311
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