Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MVTIEKIDEAIHRYYKQTHS-----VVSPDLIKAILYSVDGGGKRIRPRILLEILEGFGVELIDGHYDVAAALEMIHTGSLIHDDLPAMDNDDFRRGRLTNHKKFDEATAVLAGDSLFLDPFDLVVKAGFK--ADVTVRLIELLSMSAGSFGMVGGQMLDMKGENKVLSIDDLSLIHINKTGRLLAYPFVAAGILAEKSEEVKGKLHQAGLLIGHAFQVRDDILDVTASFEELGKTPNKDIVAEKTTYPNLLGLDKSQEILDDTLKKAQAIFQNLEKKANFNARKIIDIIEGLRLNG |
2H8O Chain:A ((47-322)) | ---AAKTEALLGHL-LSGEARADEITRPQNLLEAMRHGVLNGGKRLRPFLVIESVALLGGDA-EAGLHVGAALECLHCYSLVHDDLPAMDDDDLRRGQPTVHRKFDEATAILAGDSLLTLAFDIIASDDNPLAAERKAALVISLARAAGIGGMAGGQALDLAAEKKAPDEDGIITLQAMKTGALLRFACEAGAIIAGSNQAERQRLRLFGEKIGLSFQLADDLLDLT-----------------KGTLVALRGEAWAREKLQEQVAEASELLAPYGEKAAILIAAARFIAE------ |
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General information:
TITO was launched using:
| RESULT:
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Template: 2H8O.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -102863 for 2054 contacts (-50.1/contact) +
2D Compatibility (PS) -26966 + (NN) -9818 + (LL) 2372
1D Compatibility (HY) -10800 + (ID) 4650
Total energy: -152725.0 ( -74.35 by residue)
QMean score : 0.460
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