Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | METLQTHRVLQALIGHFTPFLESGITELIINTEQELWLYKINNTREKRGHVLFDKAFLLRFCEQLASFRGLFFDEEHPTLNCSIPFTRYRVSANHFSITTNNQITLNIRVPRLKPLSLEDFTFKVSNPESLKNLALKGHNILISGETSSGKTSLLNALLDCVNKDERVVSVEDSQELDLKAFSNCVGLL---VGKQENTRFNYEDALNMAMRLNPDRLIVGEIDTRNAALFLRLGNTGHKGMLSTIHANSAQNTLEALS-------------LNLSMRYTHSLDK--DLMRAYFKSAIDVIVHVNKINNERQIAEVLWTKEL |
4IHQ Chain:A ((254-421)) | ----------------------------------------------------------------------------------------------------------------------------------------EGMNLFVCGETASGKTTTLNAITAFIPPNLKIVTIEDTPELTV-PHSNWVAEVTRETGGEGTIKLF--DLLKAALRQRPNYILVGAIRDKEGNVAFQAMQTGH-SVMATFHAANITTLIQRLTGYPIEVPKSYINNLNIALFQTALYDKKGNLIRRVVE--VDEIIDIDPVTNDVVYIPAFTYDSV |
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General information:
TITO was launched using:
| RESULT:
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Template: 4IHQ.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -74470 for 1072 contacts (-69.5/contact) +
2D Compatibility (PS) -16203 + (NN) -6278 + (LL) 10812
1D Compatibility (HY) -12400 + (ID) 2300
Total energy: -100839.0 ( -94.07 by residue)
QMean score : 0.456
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