Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MRDLTDDVALMRPVIDALRASGCDPDRVLVRVGLPPGGLPAGRFPHSAQNLFWKAAADECGEEHVGLHLAEHLPAFHGLLLEYLFLSSDTFGAGLRHSLRYVRLLSDTLQAQLEVEGERAVLSLGESPAINRHFPEMLAGAVIRLFGALTEGEFKPLEVQLMNETGAPMERYRAVYGCPTILGMPRYALVFDAAVLDKPSRHAAPELLRMHESLARRQLAEVERLDLVRQVRELIG-ELLVDGGATLEQVAARLGMPARRLRERLAMA-GVRFNDLVTDYRCRLAKELLLKTDERIEVIVERTGFSEPSTFYRAFKRWVGETPVEFRRRGQQGRG |
3OIO Chain:A ((5-111)) | -------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------SQPKLTEAVSLMEANI--EEPLSTDDIAYYVGVSRRQLERLFKQYLGTVPSKYYLELRLNRARQLLQQTSKSIVQIGLACGFSSGPHFSSTYRNHFNITPREERAQRAQ--- |
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General information:
TITO was launched using:
| RESULT:
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Template: 3OIO.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -58135 for 733 contacts (-79.3/contact) +
2D Compatibility (PS) -11563 + (NN) -6549 + (LL) 15976
1D Compatibility (HY) -2400 + (ID) 1100
Total energy: -63771.0 ( -87.00 by residue)
QMean score : 0.756
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