Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MSKSAIFVLSGFLAFLLYALLLYGLLLERHNKEAEKILLDLNKKDEQAIDLNLEDLPSEKKNEKIEKVTEKQGDFLEPKEEPKEEPEESLEDIFSSLNDFQEKTDKNAQKDEQKNEQEEQRRLREQQRLKQNQENQEMLKGLQQNLNQFTQKLESVKNKTLDLQIPKQDGVDEKAYQEWYAQIYQILYKGWRGVFY-H--K--ASVSVLIMITKDGEF-DYTILSYSDFKDYNKSVMTLLDDLKKVDFPPYPGGNMISIKVNFTTKEEQ |
2GRX Chain:C ((148-224)) | -------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------RNQPQYPARAQALRIEGQVKVKFDVTPDGRVDNVQILSAKPANMFEREVKNAMRRWR--YEPGKPGS-GIVVNILFKING-- |
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General information:
TITO was launched using:
| RESULT:
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Template: 2GRX.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -40163 for 410 contacts (-98.0/contact) +
2D Compatibility (PS) -7933 + (NN) -5291 + (LL) 14836
1D Compatibility (HY) -800 + (ID) 700
Total energy: -40051.0 ( -97.69 by residue)
QMean score : 0.393
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