Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MIEEQRTMSVEGADQQSEKLFHYLKKVAVELDETRARLREYEQRATEPVAVVGIGCRFPGGVDGPDGLWDVVSAGRDVVSEFPTDRGWDVEGLYDPDPDAEGKTYTRWGAFLDDATGFDAGFFGIAPSEVLAMDPQQRLMLEVSWEALEHAGIDPLSLR---GSATGVYTGIFAASYGNRDT--GGLQGYGLTGTSISVASGRVSYVLGLQGPAVSVDTACSSSLVAIHWAMSSLRSGECDLALAGGVTVMGLPSIFVGFSRQRGLAA-DGRCKAFAAAADGTGWGEGAGVVVLERLSDARRLGHSVLAVVRGSAVNQDGASNGLTAPNGLAQQRVIQVALANAGLSAADVDVVEAHGTATTLGDPIEAQALLSTYGQGGPAEQPLWVGSIKSNMGHTQAAAGVAGVIKMVQAMRHGVMPATLHVDEPSPRVDWTSGAVSVLTEAREWSVD---------GRPRRAAVSSFGISGTNAHLILEEAPVPAPAEAPVEASESTGGRGRRWCRG |
4KC5 Chain:A ((8-450)) | ------------------------------------------NELANYIAVIGLGGYYPGA-DSIDELWQNLANGVDCMSDFPADR-WDHSKIYYKNRKVLGKTTCINGSFIKDVDKFDYSYFKMPKVYADHMSPEVRLFLQVAVHTFEDAGYSKETLLSRYNGDVGVLLGTMSNDYHYYGFESNVFRGSMASGSGMATIPMTVSYFYGLTGPSLFIDTMCSSSSTCIHTACQMLKHDETKMVLAGGLNLMYHPYTTVNTSQGNFTSITSESVNSYGVGADGTVIGEGIGAVLLKRLDRAIADRDQIYGVIKGSAMTNAGERNGFNVPNPDLQTLAIRQAMDQAKVHPSSISYIEGHGSGTKLGDPIEVLGLNNAFRWATDDKQFCYLGSIKSNIGHLLAASGIAGLTKTLLQFKHKQIAPSIHSSQLNQDIDFADTPFVVPQQLIEWRQPERIINGRKQVFPRRAGLTSIAAGGMNAHMIVEEYPE------------------------ |
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General information:
TITO was launched using:
| RESULT:
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Template: 4KC5.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -232094 for 4047 contacts (-57.3/contact) +
2D Compatibility (PS) -44560 + (NN) -15743 + (LL) 4800
1D Compatibility (HY) -24400 + (ID) 7100
Total energy: -319097.0 ( -78.85 by residue)
QMean score : 0.484
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