Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MSAPTKPHSPTFKPEPHSAANEPKHPAARPKHVALQQLTGAQAVIRSLEELGVDVIFGIPGGAVLPVYDPLFDSKKLRHVLVRHEQGAGHAASGYAHVT--GRVGVCMATSGPGATNLVTPLADAQMDSIPVVAITGQV------GRGLIGTDAFQEADISGITMPITKHNFLVRSGDDIPRVLAEAFHIAASGRPGAVLVDIPKDVLQGQCTFSWPPRMELPGYKPNTKPHSRQVREAAKLIAA---ARKPVLYVGGGVIRGEATEQLRELAELTGIPVVTTLMARGAFPDSHRQNLGMPGMHGTVAAVAALQRSDLLIALGTRFDDRVTG-KLDSFAPEAKVIHADIDPAEIGKNRHADVPIVGDVKAVITELIAMLRHHHIPGTIEMADWWAYLN-GVRKTYPLSYGPQSDGSLSPEYVIEKLGEIAGPDAV-FVAGVGQHQMWAAQFIRYEKPRSWLNSGGLGTMGFAIPAAMGAKIALPGTEVWAIDGDGCFQMTNQELATCAVEGIPVKVALINNGNLGMVRQWQSLFYAERYSQTDLATHSHRIPDFVKLAEALGCVGLRCEREEDVVDVINQARAINDCPVVIDFIVGADAQVWPMVAAGTSNDEIQAARGIRPLFDDITEGHA |
5AHK Chain:B ((21-529)) | -------------------------------------MKASDAVAKILADNNVLYGFELIGGMITHLVDSINLLGKTKLVSMHHEQGAAFAASAVSRVTHHKTLGLALATSGPGATNLITGIADCWLDSHPCIFLTGQVNTHELKGKRDIRQQGFQELDSVALVTSITKYAYQIKSADELVPCLRKAIQIAKEGRPGPVLLDIPMDIQRADIDEALLN---------------IAMSDLDFIINKLQNAKKPLLLIGGGAVNSSGFQKWLEQIELRGIPYVASLKGAEKIKASDLY-LGMLGAYGTRAANHAVQNCDLLLVLGSRMDVRQTGAQPEDFARNAEIIQIDLQEGQLNNRVIADF----SYQIELSEYFSRFSPLQIPVNNDWSVWTALLKEKFRVTFIDEY---TTWNLSPFGLFTQLNKLTERVALDYILDVGNNQMWAAHTLRLNAQQAMHHSGGLGSMGFAIPAAIGACYA-GKKPIIVITGDGGAQLNIQELDIIARDKLPILTIVMNNHSLGMVRGF---------SSTYWNGYTSQ---FKKIGEA------------------------------------------------------------------------ |
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General information:
TITO was launched using:
| RESULT:
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Template: 5AHK.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -321532 for 4306 contacts (-74.7/contact) +
2D Compatibility (PS) -52063 + (NN) -26585 + (LL) 7460
1D Compatibility (HY) -34800 + (ID) 8550
Total energy: -436070.0 ( -101.27 by residue)
QMean score : 0.430
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