Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MTISERQRSLLEKLNDSQKTVTAKALSEMLGVSSKTVRNDIMQINQSFSSTIIASKAGKGYFLMPNEQLSQMNLTKNNENLHFELLRHIIEQDHTNFYDLADQFFISESTLARIIKELNIVIAEKDESLCIIRKNNELLTEGGEEEKRRIFNLFLNQEIENHQLSLDKYADYFDYCNLKQLSELIIAYHKKHEFFMNDFSTISFILHIAVLIERISMGSYIERTALLEQDKTSLEMAAHLAETLEKELQINIPTQELSYIARLYSGKLTTTSTIDAQVFGSVVTRLLEAVDQNFHIDFSADEKIATYLVAHISALYKRANHKQYLTNPLTEELKNKFPFIYNVSVYASAFIQKELAITFPDDEIAYIALHFLSASETINHGKKRKILLVTPYGAGSQRLIHNQLKKIPDFSIDLLVSQSIFDIKQFTLDKEIHLILTAEPLNLTTDIPVYHYDLLLAESDLQKIKHILETKQKTESISRKFFKKELFFPKQNFKSKEETITFLCEQLTAFDYCAPDYVAKVFEREQL-SS-TCYGNYYAIPHAIQRS-AKKNAVAVCSLDKPIDWGGN--RVKLVLLLTMKEERDNSFEELFGQLVTILNERSFVKKLAKQEDFQQFIELCEQKTLDS |
2OQ3 Chain:A ((2-146)) | --------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------RLSDYFPESSISVIHSAKDWQEAIDFSMVSLLDKNYISENYIQAIKDSTINNGPYYILAPGVAMPHARPECGALKTGMSLTLLEQGVYFPGNDEPIKLLIGLSAA--DADSHIGAIQALSELLCEEEILEQLLTASSEKQLADIISR----- |
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General information:
TITO was launched using:
| RESULT:
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Template: 2OQ3.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -101577 for 1134 contacts (-89.6/contact) +
2D Compatibility (PS) -14980 + (NN) -4288 + (LL) 39916
1D Compatibility (HY) -7200 + (ID) 1300
Total energy: -89429.0 ( -78.86 by residue)
QMean score : 0.523
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