Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)



Input alignment information:
Query sequenceMIRIGTRGSLLATTQAATVRDALIAG--GHSAELVTISTEGDRSMAPIASLG-VGVFTTALREAMEAGLVDAAVHSYKDLPTAADPRFTVAAIPPRNDPRDAVVARD---GLTLGELPVGSLVGTSSPRRAAQLRALGLGLEIRPLRGNLDTRLNKV-SSGDLDAIVVARAGLARLGRLDDVTETLEPVQMLPAPAQGALAVECRAGDSRLVAVLAELDDADTRAAVTAERALLADLEAGCSAPVGAIAEVVESIDEDGRVFEELSLRGCVAALDGSDVIRASGIGSCGRARELGLSVAAELFELGARELMWGVRH
3ECR Chain:B ((23-309))VIRVGTRKSQLARIQTDSVVATLKASYPGLQFEIIAM------------KIGEKSLFTKELEHALEKNEVDLVVHSLKDLPTVLPPGFTIGAICKRENPHDAVVFHPKFVGKTLETLPEKSVVGTSSLRRAAQLQRKFPHLEFRSIRGNLNTRLRKLDEQQEFSAIILATAGLQRMGWHNRVGQILHPEECMYAVGQGALGVEVRAKDQDILDLVGVLHDPETLLRCIAERAFLRHLE--CSVPVA-----VHTAMKDGQLY----LTGGVWSLDGSDSIQET---------------------------------


General information:
TITO was launched using:
RESULT:

Template: 3ECR.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -94172 for 2026 contacts (-46.5/contact) +
2D Compatibility (PS) -28057 + (NN) -17994 + (LL) 3996
1D Compatibility (HY) -20800 + (ID) 5800
Total energy: -162827.0 ( -80.37 by residue)
QMean score : 0.463

(partial model without unconserved sides chains):
PDB file : Tito_3ECR.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-3ECR-query.scw
PDB file : Tito_Scwrl_3ECR.pdb: