Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MKKIQFFDTTLRDGEQTPGVNFDVKEKIQIALQLEKLGIDVIEAGFPISSPGDFECVKAIAK--AIKH-CSVTGLARCVEGDIDRAEEALKDAVSPQIHIFLATSDVHMEYKLKMSRAEVLA--------SIKHHISYARQKFEVVQFSPEDATRSDRAFLIEAVQTAIDAGATVI----------NIPDTVGYTNPTEFGQLFQDLRREIKQFDDITFASHCHDDLGMATANALAAIENGARRVEGTINGIGERAGNTALEEVAVALHIRKDFYQAETNIVLNQFKNSSDLISRLSGMPVPRNKAVIGGNAYAHESGIHQDGVLKNPD--------------------TYEIITPALVGVDKNS-LPLGKLSGKHAFNTRME-EMGYTLTEQEQKDAFKRFKQLADAKKEVTEEDLHALILGQSSESADDFE--LKHLQVQYVTGGVQG--AIVRIEERDGALVEDAATGSGSIEAIYNTINRLMKQDIELTDYRIQAITAGQDAQAEVHVVIKNDKGAEFHGIGIDFDVLTASAKAYLQASGKSKTASKQADFEEVK |
3HPS Chain:A ((79-606)) | ----------LRDGNQALIDPMSPARKRRMFDLLVRMGYKEIEVGFPSASQTDFDFVREIIEQGAIPDDVTIQVLTQCRPELIERTFQACSGAPRAIVHFYNSTSILQRRVVFRANRAEVQAIATDGARKCVEQAAKYPGTQWRF-EYSPESYTGTE----LEYAKQVCDAVGEVIAPTPERPIIFNLPATVEMTTPNVYADSIEWMSRNLANRESVILSLHPHNDRGTAVAAAELGFAAGADRIEGCLFGNGERTGNVCLVTLGLNLFSRG----VDPQIDFSNIDEIRRTVEYCNQLPVHERHPYGGDLVYTAFSGSHQDAINKGLDAMKLDADAADCDVDDMLWQVPYLPIDPRDVGRTYEAVI-------KGGVAYIMKTDHGLSLPRRLQIEFSQVIQKI-----EVSPKEMWDAFAEEYLAPVRPLERIRQHVDAADDDGGTTSITATVKI---NGVETEISGSGNGPLAAFVHALADV-GFDVAVLDYYEHAMSAGDDAQAAAYV----------------------------------------------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 3HPS.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -100752 for 3227 contacts (-31.2/contact) +
2D Compatibility (PS) -45279 + (NN) -10357 + (LL) 5724
1D Compatibility (HY) -17600 + (ID) 5950
Total energy: -174214.0 ( -53.99 by residue)
QMean score : 0.415
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