Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MADPGPFVADLRAESDDLDALVAHLPADRWADPTPAPGW-TIAHQIGHLLWTDRVALTAVTD--EAGFAELMTAAAANPAGFVDDAATELAAVSPAELLTDWRVTRGRLHEELLAVPD-GRKLAWFGPPMSAASM-ATARLMETWAHGLDVADALGVIRPATQRLRSIAHLGVRTRDYAFIVNNLTPPAEPFLVELRGPSGDTWSWGPSDAAQRVTGSAEDFCFLVTQRRALSTLDVNAVGEDAQRWLTIAQAFAGPPGRGR |
3DKA Chain:A ((6-154)) | ----NQIVSHFLSHRNVTNELAEKISKDHY-SYKPAETSMSAEELVKHILTSFHLFANVIKEGNASPFQNTETDLNVLAKTYTEKTVAILEQLTEEQLDREIDAFGRKVTGRALLQLAMEHEIHHKGNLFVYVREMGHTELPFYQQR------------------------------------------------------------------------------------------------------------------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 3DKA.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -24289 for 944 contacts (-25.7/contact) +
2D Compatibility (PS) -14243 + (NN) -2224 + (LL) 6844
1D Compatibility (HY) -1600 + (ID) 700
Total energy: -36212.0 ( -38.36 by residue)
QMean score : 0.260
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