Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MASHELDYRILGESMQTVEIELDPGETVIAEAGAMNYMTGDIRFTARMGDGSDGSLLGKLWSAGKRKLGGESVFMTHFTNEGQGKQHVAFAAPYPG-SVVAVDLDDVGGRLFCQKDSFLCAAYGTR-VGIAFTKRLGAGFFGGEGFILQKLEGDGLVFVHAGGTLIRRQ-LNGE-TLRVDTGCLVAFTDGIDYDVQLAGGLKSMLFGGEGLLLTT-LKGSGTVWLQSLPFSRLAGRIYDAT-FRAREE-VRTNNG--- |
3EC4 Chain:A ((5-228)) | --DHPLD-RPVWNSLGGPQSELDVAS------GNLRRLDPAYGPFAAAAPGAEAGLASLL-----QGDADEIWLVEPEPVAPPPGTRVIRVAPLLQMIADGPVPSFDDPGI-----VALGETDVPEMTALALATEPGP-------WASGTWRYGQFYGVRIDGRLA--AMAGERMRPAPNLAEVSGVCTWPEYR---GRGLAARLIRK---VIAGMAARGEVPYLHSYASNASAIRLYESLGFRARRAMTATLLGKST |
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General information:
TITO was launched using:
| RESULT:
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Template: 3EC4.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -55907 for 1630 contacts (-34.3/contact) +
2D Compatibility (PS) -21993 + (NN) 1219 + (LL) 2220
1D Compatibility (HY) -800 + (ID) 1900
Total energy: -77161.0 ( -47.34 by residue)
QMean score : 0.155
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