Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MCNQQTRVLISTILCRIAIWYDHMLFIDLVNIISREFCSAKDVYYNILQLFGIAGLGAMVRPLGASVFGHIGDRYGRKMALTIAILLISIPSSLVAFIPGYSRVGITSTILLFAIHVTQGIALGAEQGGSSVYLIEHLSNKKKLGMFFGIISFGRSIGVLLFVMIVIICKKITDFNAWGWRMPFTFSAIWGLMSAYSIYTLGETPAYEKNREQRNLPNLPIIELVKRYKRALILAVLISVPVNVAVGFTIFLRTIAKEIVQVEMYVTTYVNEIVLIITSILIPISSIALGMLADRVGKERIAILFIIITIILCCPMLSIAYYYKSYLIIMLS-VMALSIIERGINPIGIVASELFPPNVRFSGVSLSRNISFALHGGFTPMICTWLTITFPQINFVAGLYIIFCLLISLIAILQIKSQDKNFDW |
3WDO Chain:A ((28-160)) | ------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------MVLPVLTTYGMALQGASEALIGIAIGIYGLTQAVFQIP----FGLLSDRIGRKPLIVGGLAVFAAGSVI-AALS---DSIWGIILGRAL-QGS-GAIAAAVMALLSDLTREQNRTKAMAFIGV-SFGITFAIAMVLGPIITHKLGLHALFWMIAILATTGIALTIWVVPNSSTHVLNR |
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General information:
TITO was launched using:
| RESULT:
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Template: 3WDO.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -109786 for 872 contacts (-125.9/contact) +
2D Compatibility (PS) -12757 + (NN) 5537 + (LL) 22104
1D Compatibility (HY) -4800 + (ID) 850
Total energy: -100552.0 ( -115.31 by residue)
QMean score : 0.113
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