Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MPATQQMSRLVDSPDGVRIAVYHEGNPDGPTVVLVHGFPDSHVLWDGVVPLLAERFRIVRYDNRGVGRSSVPKPISAYTMAHFADDFDAVIGELSPGEPVHVLAHDWGSVGVWEYLRRPGASDRVASFTSVSGPSQDHLVNYVYGGLRRPWRPRTFLRAISQTLRLSYMALFSVPVVAPLLLRVALSSAAVRRNMVGDIPVDQIHHSETLARDAAHSVKTYPANYFRSFSSSRRGRAIPIVDVPVQLIVNSQDPYVRPYGYDQTARWVPRLWRRDIKAGHFSPMSHPQVMAAAVHDFADLADGKQPSRALLRAQVGRPRGYFGDTLVSVTGAGSGIGRETALAFAREGAEIVISDIDEATVKDTAAEIAARGGIAYPYVLDVSDAEAVEAFAERVSAEH-GVPDIVVNNAGIGQAGRFLDTPAEQFDRVLAVNLGGVVNGCRAFGQRLVERG---TGGHIVNVSSMAAYAPLQSLSAYCTSKAATYMFSDCLRAELDAAGVGLTTICPGVIDTNIVATTGFHAPGTDEEKIDGRRGQIDKMFALRSYGPDKVADAIVSAVKKKKPIRPVAPEAYALYG-ISRVLPQALRSTARLRVI |
3LLS Chain:A ((50-475)) | -------------PQPETLRRYRAGEPPLTGSLLIGG---AGRVVEPLRAALEKDYDLVGNDSFGGLVFDATGITEPAGLKGLHEFFTPVLRNLGRCGRVVVVGGT----------------------------------------------------------------------------------------------------PEAAASTNERIAQRALEGFTRSLGKELRRGA------TTALVYLSPDAKPAATGLESTMRFL---------LSAKSAYVDGQVFSVGADDSTPPADWEKP---------------LDGKVAIVTGAARGIGATIAEVFARDGAHVVAIDVESA--AENLAETASKVG-GTALWLDVTADDAVDKISEHLRDHHGGKADILVNNAGITRDKLLANMDDARWDAVLAVNL----LAPLRLTEGLVGNGSIGEGGRVIGLSSIAGIAGNRGQTNYATTKAGMIGITQALAPGLAAKGITINAVAPGFIERR-----------------------------LNSLLQGGQPVDVAEAIAYFAS-----PASNAVTGNVIRVCGQAMIGA------ |
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General information:
TITO was launched using:
| RESULT:
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Template: 3LLS.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -120327 for 3211 contacts (-37.5/contact) +
2D Compatibility (PS) -43214 + (NN) -19399 + (LL) 13408
1D Compatibility (HY) -17200 + (ID) 5350
Total energy: -192082.0 ( -59.82 by residue)
QMean score : 0.348
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