Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MLQNQDTMEILSNSTSKFPTFLLTGIPGLESAHVWISIPFCCFYAIALSGNSVILFVIITQQSLHEPMYYFLFRLSATDLGLTVSSLSTTLGILWFEAREISLYSCIVQMFFLHGFTFMESGVLVATAFDRYVAICDPLRYTTILTNSRIIQMGLLMITRAIVLILPLLLLLKPLYFCRMNALSHSYCYHPDVIQLACSDIRANSICGLIDLILTTGIDTPCIVLSYILIIHSVLRIASPEEWHKVFSTCVSHVGAVAFFYIHMLSLSLVYRYGRSAPRVVHSVMANVYLLLPPVLNPIIDSVKTKQIRKAMLSLLLTK- |
1IO2 Chain:A ((1-213)) | --------------------MKIAGIDEAGRG--------------PVIGPMVIAAVVVDENSLPKLEELKVRDSKKLT-----------------PKRREKLFNEILGV-----------------LDDYVILELPPDVIGSR--EGTLNEFEVENFAKALNSL--KVKP----DVIYADAADVDEERFARELGERLNF--------EAEVVAKHKADDIFPVVSAASILAKVTRDRAVEKLKEEYGE---------------------IGSGYPSDPRTRAFLENYYREHGEFPPIVRKGW--KTLKKIAEKVESEKK |
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General information:
TITO was launched using:
| RESULT:
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Template: 1IO2.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -270414 for 1783 contacts (-151.7/contact) +
2D Compatibility (PS) -22130 + (NN) -3579 + (LL) 8768
1D Compatibility (HY) 800 + (ID) 1400
Total energy: -287955.0 ( -161.50 by residue)
QMean score : 0.311
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