Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MSSILTDFEPKFLSSDDLLNLYAEYCNGHYCDFKYKQRRLSDGNIQSHLYFKKDHFIHDYNGIETFKRFIAVKAYDVDNITSLALSNLLCEKFNLDILLTIEAMDKERALFFIRERKKRSKDISYQNIEYLEQMVSTDRAQIQKVSLSIMVFANSKKELDKKSIIVYNTLKKEGFSAVLESINMRPIFFSFFPERNFLNSRLRPQTSQNIASLIMFEKYQEGFKENSWGDCPVSVFKNQNGSAHFFNFQAKQGKDKNDNVVGHTMIIGSTGSGKSTFISFLIANLLTKYDMSVVALDRMNGLEIMTDFFEGQYNTANTDGGFYINPFSLKDSEENRQFLANWIKFMLNIDSDNQQDNKASQSIDKVIRDTYNYMGDQKNQINLLEIAKNLGSSEQDFNEILKSQGEKIYFKNFQDCLDFSNSPLSVINMDAFANDKKLMGLIAMYLFHKLFFEAK-EHNKPFFYSLMKLKTTLCIL |
4AV9 Chain:A ((14-338)) | SNPIV--------------------------DYEFNQD-------QSCLIVSTPKSFDIYN-VHPLKRIMSQEMPDAGTIRMLHRTN------------YIAFVSTKKELLHIWDDVKK-QDITRVKLD----------AAVKDLFLS------------REFIVVSQ-----------------GDVISIFKFGNPWN---KITEDIKFGGVCEFA-----------NGLLVYSNEFNLGQIHVTRLQ-----TDAEQVVGKGVLVKAHAN-----------------PVKMVRLNR-----------KGDMVATCSQDGTLIRVFQTDNGVLVREFR-------RGLDRTSIIDMRWSPDGSKLAVVSDKW------TLHVFEVFNDAENKRHVLKDWINSEWSICNFK-----LKVSKGSNDC--KIAWISDT---GLVIVWPNRRLADTFKLNYNDDEHVWWLQLNQRNEIP |
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General information:
TITO was launched using:
| RESULT:
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Template: 4AV9.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -84373 for 2518 contacts (-33.5/contact) +
2D Compatibility (PS) -33370 + (NN) -930 + (LL) 10664
1D Compatibility (HY) -18400 + (ID) 3250
Total energy: -129659.0 ( -51.49 by residue)
QMean score : 0.202
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