Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
| Query sequence | MTSNFGTKFSAEDFFRDFCPTVDGEVKKERFEQELLALKEETEKRKKLELSTLKGEKAEKKKKLEQELLTLKKRELYRQYVSLATMIPFALLMAIELKKICSDQILLVVISVGLGHTLLPFSVLSLICMLYLIYNNRKIIQKERELENIENGREIEKKKYNCPDIDQCLAYIEVISTVLVIVGQIMDEVSPLKVAEEALFFTASILSFAIAFYNYKKENKENKERETEKLSHAEELSKNNSNIPMAGLMLAGSSVMLIRRVMLITLASSLSPALGLAAIALLIVGSGLITHSYKRELKNVKVSGKSITGASVIDIVDRDSIHICTNM |
| 2H3O Chain:A ((43-68)) | -----------------------------------------------------------------------------------------------------------------LDYVLLPALAIFIGLTIYAIQRKRQA-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 2H3O.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -13478 for 108 contacts (-124.8/contact) +
2D Compatibility (PS) -2586 + (NN) -1926 + (LL) 25648
1D Compatibility (HY) -800 + (ID) 50
Total energy: 6808.0 ( 63.04 by residue)
QMean score : -0.202
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