Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MSYAVCRMQKVKSAGLKGMQFHNQRERKSRTNDDIDHERTRENYDLKNDKNIDYNERVKEIIESQKTGTRKTRKDAVLVNELLVTSDRDFFEQLDPGEQKRFFEESYKLFSERYGKQNIAYATVHNDEQTPHMHLGVVPMRDGKLQGKNVFNRQELLWLQDKFPEHMKKQGFELKRGERGSDRKHIETAKFKKQTLEKEIDFLEKNLAVKKDEWTAYSDKVKSDLEVPAKRHMKSVEVPTGEKSMFGLGKEIMKTEKKPTKNVVISERDYKNLVTAARDNDRLKQHVRNLMSTDMAREYKKLSKEHGQVKEKYSGLVERFNENVNDYNELLEENKSLKSKISDLKRDVSLIYESTKEFLKERTDGLKAFKNVFKGFVDKVKDKTAQFQEKHDLEPKKNEFELTHNREVKKERSRDQGMSL |
3EDV Chain:A ((2-323)) | -SHMRHRLFQLNREVDDLEQWIAEREVVAGSHE---LGQDYEHVTMLQERFREFARDTGNI------GQERVDTVNHLADELINSGHSD---AATIAEWKDGLNEAWADLLELIDTRTQILAASYELHKFYHDAKEIFGRIQDKHK---------------KLPE------------ELGRDQNTVETLQRMHTTFEHDIQALGTQVRQLQEDAARLQAAYAG---------DKADDIQKRENEVLEAWKSLLDACESRRVRLVDTGDKFRFFSMVRDLMLWMEDVIRQIEAQEKPR-------------------------DVSSVELLMNNHQGIKAEIDARNDSFTTCIELGKSLLAR------------------------KHYASEEIKEKLLQLTEKRKEMIDKWEDRWEWLRL |
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General information:
TITO was launched using:
| RESULT:
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Template: 3EDV.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) 128540 for 2111 contacts (60.9/contact) +
2D Compatibility (PS) -33919 + (NN) -8539 + (LL) 6640
1D Compatibility (HY) -7600 + (ID) 2400
Total energy: 82722.0 ( 39.19 by residue)
QMean score : 0.265
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