Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MSTLGDLLAEHTVLPGSAVDHLHAVVGEWQLLADLSFADYLMWVRRDDGVLVCVAQCRPNTGPTVVHTDAVGTVVAANSMPLVAATFSGGVPGREGAVGQQNSCQHDGHSVEVSPVRFGDQVVAVLTRHQPELAARRRSGHLETAYRLCATDLLRMLAEGTFPDAGDVAMSRSSPRAGDGFIRLDVDGVVSYASPNALSAYHRMGLTTELEGVNLIDATRPLISDPFEAHEVDEHVQDLLAGDGKGMRMEVDAGGATVLLRTLPLVVAGRNVGAAILIRDVTEVKRRDRALISKDATIREIHHRVKNNLQTVAALLRLQARRTSNAEGREALIESVRRVSSIALVHDAL------SMSVDEQVNLDEVIDRILPIMNDVASVDRPIRINRVGDLGVLDSDRATALIMVITELVQNAIEHAFDPAAAEGSVTIRAERSARWLDVVVHDDGLGLPQGFSLEKSDSLGLQIVRTLVSAELDGSLGMRDARERGTDVVLRVPVGRRGRLML |
4CTI Chain:A ((332-535)) | ----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------DRTLLMAGVSHDLRTPLTRIRLATEMMSEQDG--YLAESINKDIEECNAI--IEQFIDYLRTGQE------DLNAVLGEVIA----------EIETALY------KMH-PLSIKRAVANMVVNAARYGN------GWIKVSSGTEP--AWFQVEDDGP---------SGTGLGLAIVQRIVD-NHNGMLELG------LSIRAWL---------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 4CTI.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -76200 for 941 contacts (-81.0/contact) +
2D Compatibility (PS) -15949 + (NN) -7970 + (LL) 22356
1D Compatibility (HY) -8400 + (ID) 1150
Total energy: -87313.0 ( -92.79 by residue)
QMean score : 0.539
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