Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MQKRVVILLLDSFGIGASEDAKDFGDLGANTLGNIAKACFNNLADSNDRNGVLKLPNLEGLGLG-LSALKAAN--ELPLGFQLKPNLIGAYAYAKELSSAKDTISGHWEMMGAPVLFEWGYFKDKNDSFPKEILDEIMHKTKIKGYLGNCHASGTEIIKDLGEKHLETLYPIFYTSADSVFQIAAHEERFGLDHLYALCEEAFQIL--EPLKIARVIARPFIGTNRENFKRTANRKDYAIKPHKKLLFETFIEEKQGEVISIGKIADIYAHVGITQKFKAGSLMELCDVTLDQVKNAPNNSLIFTNFVHFDSDYGHRRDVSGYANALEYFDARLKEVLDNLRENDLLILCADHGCDPSFKGTDHTREYIPVLFYHKDLQPAF--LGKSETFADIGQSIAYFLGLSPLDYGKNLLNFKGQP |
4LRD Chain:A ((27-412)) | --KRIFLVVMDSVGIGEAPDAEQFGDLGSDTIGHIAEHM----------NG-LQMPNMVKLGLGNIREMKGISKVEKPLGY---------YTKMQEKSIGKDTMTGHWEIMGLYIDTPFQVFPE---GFPKELLDELEEKTGRK-IIGNKPASGTEILDELGQEQMETGSLIVYTSADSLLQIAAHEEVVPLDELYKICKIARELTLDEKYKVGRVIARPFVG-EPGNFTRTPNRHDYALKPFGRTVMNE-LKDSDYDVIAIGKISDIYDGEGVTESLRTKSNMDGMDKLVDTL-NMDFTGLSFLNLVDFDALFGHRRDPQGYGEALQEYDARLPEVFAKLKEDDLLLITADHGNDPIHPGTDHTREYVPLLAYSPSMKEGGQELPLRQTFADIGATVAENFGVKMPEYGTSFLNEL--- |
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General information:
TITO was launched using:
| RESULT:
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Template: 4LRD.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -295791 for 3449 contacts (-85.8/contact) +
2D Compatibility (PS) -40584 + (NN) -13138 + (LL) 1152
1D Compatibility (HY) -32800 + (ID) 9000
Total energy: -390161.0 ( -113.12 by residue)
QMean score : 0.571
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