Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | ----------------------------METNQILETIRMIEEEKLDIRTITMGISLLDCMDGDGEAARKKIYQKI-VTKARNLVAVGEAIESEFGIPIINKRISVTPIAIIA-GSSADTDYVEFAKTLDAAAKEVGVNFIGGYSALVQKGYTKGDEILIRSIPQALAQTE------R-VCSSVNVGSTRTGINMDAVRQMGEVIKETADLTADTQGLGCAKLVVFANAVEDNPFMAGAFHGVGEADCVINVGVSGPGVVKRAIEKVKGEPFDIVAETVKQTAFKITRMGQLVGQVASEKLGVP-FGIVDLSLAPTPA-----------------------------------------IGDSVAHILEEMGLEMVGTHGT------TAALALLNDAVKKGGVMACGHVGGLSGAFIPVSEDA-GMIEAVQQ--GA-L-NLEKL-EAMTAICSVGLDM-IAVPGDT-----TAETLAAMIADEAAIGVINNKTTAVRVI----PASGTKVGDMVEFGGLLGTAPVMPVNGKSSVDFIARGGRIPAPIHSFKN- |
3IUK Chain:A ((11-562)) | VRPKSAIDAVADAYTEKLIELNPSFATTLGLPGHETEYQDYSPAGAAAHAEATRLALEALAGLEPSDDVDAVTLDAMRERLGLELEIHQSGWDAADLNNIASPAQDIRAIFDLMPTDTVEHWEHIAGRAANVPGAIE-GYIASLRAAKDDRKVAAARQIRIVIEQTGRYAAEDGFFAKMAADASLGDAPLPAEVQDKLDAGTSAARSAYSALGAFLRDELLPVAPEKDAVGRERYSLASRSFIGAEVDLEETYAWGVQELERLISEQEKVAGQIKPGASIEEAKSILNNDPARQIKGTDALKAWMQELSDRAVSELADVHFDIPDVMKTLECMIAPTDEGGIYYTGPSDDFSRPGRMWWSVPAGEDTFTTWSETTTVFHEGVPGHHLQVATATYRRELLNNWRRNVCWVSGHGEGWALYAEQLMLELGYLKDPGDHMGMLDGQRMRAARVVFDIGVHLELPVPERWGTGTWTPEKGFDFLKANLDISEGQLQFEFTRYLGWPGQAPSYKVGQRLWEQIRAELESREGFDLKSFHSKALNIGSVGLDVLRRALL |
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General information:
TITO was launched using:
| RESULT:
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Template: 3IUK.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -46436 for 3335 contacts (-13.9/contact) +
2D Compatibility (PS) -45828 + (NN) 1540 + (LL) 192
1D Compatibility (HY) 12800 + (ID) 2000
Total energy: -79732.0 ( -23.91 by residue)
QMean score : 0.102
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