Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MGEKMAIWRTKKPATKQKIVSDLQELGIKKGDTIIFHASMSKAHWICGGPVTVILALQELVGELGNIVMPAQTGQLSDPAKWENPPVPESWWKIIRRETPPFDPLVTPTRGMGVIAETFRTMPDVERSFHPYHSFCAWGKDKKQILANQPLAKSMGDESPLGKMYQLDAKIILFGVDNNNNTSLHLAEERSNAFPLIENQAAFL---KNGEIIWEKYQEIDYNSEVFIALGRAYEKEHDFHPTTIIG-APTKIYDMRDLVDFGTKYFQTKNH |
3SMA Chain:B ((19-274)) | ----------RELVTRDRLASDLAALGVRPGGVLLVHASLSALGWVCGGAQAVVLALQDAVGKEGTLVMPTFSGDLSDPSTWRRPPVPEDWWPVIREQMPPFDPDLTPTRGMGAVAECFRRAAGAVRSGHPQNSFAAWGAHAEQVVAEHGLTERLGRGSPLEQVYRLDGQVLLLGCGFESNTSFHLAEYRT-AYPGRRSHRRRVPVPEGDRVRWVEQEDIVYFEEDFQTMGESCLTRTPGHSRGTVGEAAAVLYGQRAFVDLACEWM----- |
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General information:
TITO was launched using:
| RESULT:
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Template: 3SMA.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -95634 for 2077 contacts (-46.0/contact) +
2D Compatibility (PS) -27163 + (NN) -11401 + (LL) 1188
1D Compatibility (HY) -17600 + (ID) 5050
Total energy: -155660.0 ( -74.94 by residue)
QMean score : 0.479
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