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



Input alignment information:
Query sequenceMLIRIGTRGSSLAIAQALEAKQKLLDLFSSLSVEIIKIKTSGDKYANANLAEIGGKGLFIKEIETELIKSNIDMAVHSLKDVPAFFSKDLTIPCILERLSPYDTFISNKY---KSLKSLPQQAIIATSSIRRKVQLLNFRPDLNIVPLRGNVTTRL----QNQSFDGIILAEAGLIRLKKDYLITEVLSPKTMLSAVGQGAICIQCRKNDIKIIDLLEKINNNKSFIRVKSERSFMKTVNGSCFTPLAALAKYVSENVLHLYCMLADKKNIYFTERTSFVEDAEKMGMDAGLELKSKCL
3ECR Chain:A ((23-269))-VIRVGTRKSQLARIQTDSVVATLKASYPGLQFEIIAM-------------------LFTKELEHALEKNEVDLVVHSLKDLPTVLPPGFTIGAICKRENPHDAVVFHPKFVGKTLETLPEKSVVGTSSLRRAAQLQRKFPHLEFRSIRGNLNTRLRKLDEQQEFSAIILATAGLQRMGWHNRVGQILHPEECMYAVGQGALGVEVRAKDQDILDLVGVLHDPETLLRCIAERAFLRHLE--CSVPVAVHTAMKDGQLYLTGGVWSLDGSDSIQETMQATIHVPAQHEDGPEDDPQLVG


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) -112403 for 1682 contacts (-66.8/contact) +
2D Compatibility (PS) -23909 + (NN) -13435 + (LL) 308
1D Compatibility (HY) -18800 + (ID) 4200
Total energy: -172439.0 ( -102.52 by residue)
QMean score : 0.418

(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: