Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | --------------------MAFDA-ARYVHRY--------YASLAPAPGNEYPRLRAWEYLWEYVWDPSRSWDDLTAPEQLDTTALHLGFYLANWGMFRGSSGLLQNSNLDLMKALA--RQLFSGAGPELFELSLVDFAGNGARLAHNRKLLETVLGSMDALSSR-------VSWTDTLKSKILLG----------------VWGEFPALDRHYVAACRALYPRRGLTSVNG---GTLTALHRLIGEERLSFPRLETARKGLLY----PTGRLADMAFFQYGLENA |
1LUA Chain:A ((1-287)) | SKKLLFQFDTDATPSVFDVVVGYDGGADHITGYGNVTPDNVGAYVDGTIYTRGGKEKQSTAIFVGGGDMAAGERVFEAVKKRFFGPFRVSCMLDSNGSNTTAAAGVALVVKAAGGSVKGKKAVVLAGTGPVGMRSAALLAGEGAEVVLCGRKLDKAQAAADSVNKRFKVNVTAAETADDASRAEAVKGAHFVFTAGAIGLELLPQAAWQNESSIEIVADYNAQPPLGIGGIDATDKGKEYGGKRAFGALGIGGLKLKLHRACIAKLFESSEGVFDAEEIYKLAKEMA |
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General information:
TITO was launched using:
| RESULT:
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Template: 1LUA.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -52188 for 1755 contacts (-29.7/contact) +
2D Compatibility (PS) -23886 + (NN) -2427 + (LL) 0
1D Compatibility (HY) 4400 + (ID) 1400
Total energy: -75501.0 ( -43.02 by residue)
QMean score : 0.171
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