Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MTEHTDFELLELATPYALNAVSDDERADIDRRVAAAPSPVAAAFNDEVRAVRETMAVVSAA-TTA--------EPPAHLRTAILDATKPEVRRQSRWRTAAFASAAAIAVGLGAFGLGVLTRPSPPPTVAEQVLTAPDVRTVSRPLGAGTATVVFSRDRNTGLLVMNNVAPPSRGTVYQMWLLGGAKGPRSAGTMGTAAVTPSTTATLTDLGASTALAFTVEPGTGSPQPTGTILAELPLG |
3HUG Chain:B ((25-86)) | ------HHYAMWDAAYVLGALSAADRREFEAHLAGCP-----ECRGAVTELCGVPALLSQLDRDEVAAISESA------------------------------------------------------------------------------------------------------------------------------------------------------------------------ |
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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) -14542 for 291 contacts (-50.0/contact) +
2D Compatibility (PS) -5296 + (NN) 1422 + (LL) 8744
1D Compatibility (HY) -3600 + (ID) 500
Total energy: -13772.0 ( -47.33 by residue)
QMean score : 0.597
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