Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MTSNFGTKFSAEDFFRDFCPTVDGEVKKERFEQELLALKEETEKRKKLELSTLKGEKAEKKKKLEQELLTLKKRELYRQYVSLATMIPFALLMAIELKKICSDQILLVVISVGLGHTLLPFSVLSLICMLYLIYNNRKIIQKERELENIENGREIEKKKYNCPDIDQCLAYIEVISTVLVIVGQIMDEVSPLKVAEEALFFTASILSFAIAFYNYKKENKENKERETEKLSHAEELSKNNSNIPMAGLMLAGSSVMLIRRVMLITLASSLSPALGLAAIALLIVGSGLITHSYKRELKNVKVSGKSITGASVIDIVDRDSIHICTNM |
1XRD Chain:A ((7-32)) | ----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------LFDPRQALVGLATFLFVLALLIHFILLSTERFNWLEGASTKPVQTS------------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 1XRD.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -6628 for 102 contacts (-65.0/contact) +
2D Compatibility (PS) -2708 + (NN) -1964 + (LL) 24756
1D Compatibility (HY) -2800 + (ID) 250
Total energy: 10406.0 ( 102.02 by residue)
QMean score : -0.008
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