Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MYQQSSFKENLIHWFDENQREMPWRQTTNPYYIWLSEVMLQQTQVKTVIDYYHRFVERFPTVEVLSQASEDEVLKYWEGLGYYSRARNFHTAIKEVYDKYEGLVPKDPDQFKALKGVGPYTQAAVMSIAYNVPLATVDGNVFRVWSRLNDDYRDIKLQSTRKSYEQ---ELLPYVTTEAGTFNQAMMELGALICTPKNPLCLFCPVQENCEAFDKGTFEKLPVKSKNVSKKVIEQSVFLIRNNQGQYLLQKR-SEKLLHGMWQFPMFESEHARRK------MTEKIGHDIQPVETPIFELKHQFTHLTWKIKVYAA----SGAIN--IETLPDDMIWFNLSDRDQYTFPVPMSKIYQFING |
4YPR Chain:B ((11-356)) | -FPAREFQRDLLDWFARERRDLPWRKDRDPYKVWVSEVMLQQTRVETVIPYFEQFIDRFPTLEALADADEDEVLKAWEGLGYYSRVRNLHAAVKEVKTRYGGKVPDDPDEFSRLKGVGPYTVGAVLSLAYGVPEPAVNGNVMRVLSRLFLVTDDIAKCSTRKRFEQIVREIMAY--ENPGAFNEALIELGALVCTPRRPSCLLCPVQAYCQAFAEGVAEELPVKMKKTAVKQVPLAVAVLADDEGRVLIRKRDSTGLLANLWEFPSCETDGADGKEKLEQMVG-----QVELTE-PIVSFEHAFSHLVWQLTVFPGRLVHGGPVEEPYRLAPEDEL-------KAYAFPVSHQRVWR---- |
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General information:
TITO was launched using:
| RESULT:
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Template: 4YPR.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -157953 for 2501 contacts (-63.2/contact) +
2D Compatibility (PS) -33066 + (NN) -4256 + (LL) 1212
1D Compatibility (HY) -34400 + (ID) 7800
Total energy: -236263.0 ( -94.47 by residue)
QMean score : 0.460
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