Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MSAKAIDYRTRLSDFMTEHVFGAEADYDDYRRAAGPADHTAPPIIEELKTKAKDRGLWNLFLSAESGLTNLEYAPLAEMTGWSMEIAPEALNCAA-----PDTGNMEILHMFGTEQQRAQWLRPLLDGKIRSAFSMTEPAVASSDARNIETTISRDGADYVINGRKWWTSGAADPRCKILIVMGRTNPDAAAHQQQSMVLVPIDTPGVTIVRSTPVFGWQDRHGHCEIDYHNVRVPATNLLGEEGSGFAIAQARLGPGRIHHCMRALGAAERALALMVNRVRNRVAFGRPLAEQGVVQQAIAQSRNEIDQARLLCEKAAWTIDQHGNKEARHLVAMIKAVAPRVACDVIDRAIQVHGAAGVSDDTPLARLYGWHRAMRIFDGPDEVHLRSIARAELSREKSTFAAAVT |
4M9A Chain:A ((47-383)) | ---------------------------------------------DEVVAQMGELGFLGMIVPADWGGSYTDYVAYALAL---EEIAAGCASCATLVSVHNSVGCGPVLN-YGTTEQKERWLRDLASGKTVGAFSLTEPH------HNLRTRAELRDGKWILNGSKQFVTNGA--RAGLAIVFAMTDPDEGKRGLSAFV-VPTDTPGFIVGKPEKKMGIRASD-TCPITLENCAIPQENLLGKRGEGLKIALSNLEGGRIGIAAQATGIARAAFDRARRYARERVQFGKPIAEHQAIAEKLANMATQINAARLLTHHAARL--RTAGLPCLSEASQAKLFASEMAEAVCSDAIQIHGGYGFLVDYEVERHYRDARITQIYEGTSEVQRMVIAR--------------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 4M9A.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -181838 for 2904 contacts (-62.6/contact) +
2D Compatibility (PS) -35319 + (NN) -18710 + (LL) 4652
1D Compatibility (HY) -13200 + (ID) 5250
Total energy: -249665.0 ( -85.97 by residue)
QMean score : 0.465
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