Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MYREITAVE-HDRFVSESNQTNLLQSSNWPKVKDNWGSQLLGFFDGETQI-ASASILIKSLPLGFSMLYIPRGPIMDYSNLDIVTKVLKD-LKAFGKKQRALFIKCDPLIYLKMVNAKDFENSPDEKEGLIAIDHLQRAGADWTGRTTDLAHTIQPRFQANLYANQF-----GLDKMSKKTRQAIRTSKNKGVDIQFG-SHELLEDFAELMKKTEDRKGINLRGIDYYQKLLDTYPNNSYITMASLDVAKRLEKIEKECQIAQSERIKSLELNREKKVKQHQGTIDRLNKEIDFLKEAQKAYDRDIIPLAATLTLEFGNTSENIYAGMDDYFKSYSAPIYTWFETAQRAFERGNIWQNMGGIENDLS-GGLYHFKSKF-EPIIEEFIGEFNIPVNRLLYKASNYVYALRKKRNS |
3GKR Chain:A ((11-322)) | ------AVERYEEFMRQSPYGQVTQDLGWAKVKNNWEPVDVYLEDDQGAIIAAMSMLLGDTPTDKKFAYASKGPVMDVTDVDLLDRLVDEAVKAL--DGRAYVLRFDP-----EVAYSDEFNTTLQDHGYVT---RNRNVAD-----AGMHATIQPRLNMVLDLTKFPDAKTTLDLYPSKTKSKIKRPFRDGVEVHSGNSATELDEFFKTYTTMAERHGITHRPIEYFQRM-----------QAAFD--------------ADTMRIFVAE--REGKL------------------------------LSTGIALKYGRKIWYMYAGSMD-GNTYYAPYAVQSEMIQWALDTNTDLYDLGGIESESTDDSLYVFKHVFVKDAPREYIGEIDKVLDPEVYAELVKD--------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 3GKR.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -43872 for 2375 contacts (-18.5/contact) +
2D Compatibility (PS) -31415 + (NN) -3047 + (LL) 6764
1D Compatibility (HY) -18000 + (ID) 4850
Total energy: -94420.0 ( -39.76 by residue)
QMean score : 0.371
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