Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | LLVEELKTKYLVKDICQILQVPLSTYYRWKKKDFSQSSLEKKIGQLCKAYQFTYGYRKIAALMKQEEQVGINKVQRIMQKYQWQCQVKVKKKNRPGSAYYQTENHLNRNFQASQPLEKLTTD-ITYLYFGDCRLYLSSIMDLYNGEIVAYSIGEKQDTELV--LDTLNQLSLPEGSLLHSDQGSVYTSYEYYQCCKKKNVIRSMSRKGTPADNAPIECFHSSLKCETFYHKTAYKYAKSIVIQIVKDYIKYYNEKRIQQKLGYQSPINFRKQAA |
3OS1 Chain:A ((117-231)) | -----------------------------------------------------------------------------------------------------------RPDRPQKPFDKFFIDYIGPLPPSQGYLYVLVVVDGMTGFTWLYPTKAPSTSATVKSLNVLTSIAIPK--VIHSDQGAAFTSSTFAEWAKERGIHLEFSTPYHPQSSGKVERKNSDIK-------------------------------------------------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 3OS1.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -18734 for 800 contacts (-23.4/contact) +
2D Compatibility (PS) -11851 + (NN) -5517 + (LL) 13424
1D Compatibility (HY) -4000 + (ID) 1400
Total energy: -28078.0 ( -35.10 by residue)
QMean score : 0.244
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