Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MFLSIMAGVIAFVLTVIAIPRFIKFYQLKKIGGQQMHEDVKQHLAKAGTPTMGGTVFLIVALLVSLIFSIILSKENSGNLGATFGILSVVLIYGIIGFLDDFLKIFKQINEGLTPKQKMSLQ-----LIAGLIFYFVHVLPSGTSAINIFGF----YLEVGYLYAFFVLFWVVGFSNAVNLTDGIDGLASISVVISLITYGIIAY-----NQTQF----------DILLIIVIMIGALLGFFVFNHKPAKVFMGDVGSLALGAMLAAISIALRQEWTLLFIGFVYVFETSSVMLQVAYFKYTKKKTGVGKRIFRMTPFHHHLELGGVSGKGNKWSEWKVDAFLWAIGIFMSAITLAILYL |
4J72 Chain:A ((30-339)) | -FRSFTAVLIAFFLTLVLSPSFIN--RL-----------------KKYTPTMGGIVILIVVTLSTLLLM-------RWDIKYTWVVLLSFLSFGTIGFWDDYVKL--KNKKGISIKTKFLLQVLSASLISVLIYYWADI-----DTILYFPFFKELYVDLGVLYLPFAVFVIVGSANAVNLTDGLDGLAIGPAMTTATALGVVAYAVGHSKIAQYLNIPYVPYAGELTVFCFALVGAGLGFLWFNSFPAQMFMGDVGSLSIGASLATVALLTKSEFIFAVAAGVFVFETISVILQIIYFRWTG-----GKRLFKRAPFHHHLELNGLPEPKIVVRMWIISILLAIIAISMLK-------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 4J72.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -317395 for 2236 contacts (-141.9/contact) +
2D Compatibility (PS) -26901 + (NN) -6274 + (LL) 2544
1D Compatibility (HY) -34400 + (ID) 5950
Total energy: -388376.0 ( -173.69 by residue)
QMean score : 0.291
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