Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MKVSIIGATGYGGLELIRLLHQHSS-----VDIATLHSFSAQAETLATFYPHLKDLAVSPLEKINPTE--IIEKSDTVFIATPSGIAKDIALPYVDAGLNVIDLSGDFRLKDRQLYEKWYGKSAAPTEYIGKAEYGLAEF---REK-KETTFIANPGCYATATLLGLAPLATNKLIDPTSIIVDAKSGISGAGKVPSASTHFTETNENMTLYKMNS-HQHIPEIMQQLTKWDESIPAIQFSTSLIPITRGIFTTIYVKPKNPITQKELHKLYESTYDNAPFVRIQPENVYPTVKQVTASNYCDIGLAYNEKTNVITIVSVIDNLVKGAAGQAIQNLNIMANFAESDGLRFIPVYP |
2I3A Chain:D ((11-352)) | -KVAVAGASGYAGGEILRLLLGHPAYADGRLRIGALTAATSAGSTLGEHHPHLTPLAHRVVE---PTEAAVLGGHDAVFLALPHGHSAVLAQQLSPETL-IIDCGADFRLTDAAVWERFYGSS-----HAGSWPYGLPELPGARDQLRGTRRIAVPGCYPTAALLALFPALAADLIEP-AVTVVAVSGTSGAGRAATTDLLGAEVIGSARAYNIAGVHRHTPEIAQGLRAVTDRDVSVSFTPVLIPASRGILATCTARTRSPLSQ--LRAAYEKAYHAEPFIYLMPEGQLPRTGAVIGSNAAHIAVAVDEDAQTFVAIAAIDNLVKGTAGAAVQSMNLALGWPETDGLSVVGVAP |
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General information:
TITO was launched using:
| RESULT:
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Template: 2I3A.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -184546 for 2937 contacts (-62.8/contact) +
2D Compatibility (PS) -35819 + (NN) -12428 + (LL) 840
1D Compatibility (HY) -18400 + (ID) 6300
Total energy: -256653.0 ( -87.39 by residue)
QMean score : 0.453
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