Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MESRILSLAALTVLELSPPDMVEAAARAGYSHVGLRLVPATVEEHHYPLLADAGLRRRTLARLRDSG--VRTLDVEILRLRP---------DTRVGEFAAVLEVGAEFGARYVLVAG--------NDDDERRSADNFAALCDLARPLGLDPHLEFMPWTGIRDLRQAARVVEAAARDNAGLLLDAFHFDRSASSLEDLRAIPPARLGYAQLCDVVGPRPTSMDEILRQAREERRFPGDGGLDLLALLRALPENLPLSLEVPALDLLARGVDGAERARLAIERTRALLARL-- |
3CQJ Chain:A ((16-291)) | -QIPLGIYEKALPAGECWLERLQLAKTLGFDFVEMSVDET--DERLSRLDWSREQRLALVNAIVETGVRVPSMCLSAHRRFPLGSEDDAVRAQGLEIMRKAIQFAQDVGIRVIQLAGYDVYYQEANNETRRRFRDGLKESVEMASRAQVTLAMEIMDYPLMNSISKALGYAHYLNNPWFQLYPDIGNLSAWDNDVQMELQAGIGHIVAVHVKDTKPGVFKNVP------------FGEGVVDFERCFETLKQ-SGYCGPYLIEMWSETAEDPAAEVAKARDWVKARMAKAGM |
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General information:
TITO was launched using:
| RESULT:
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Template: 3CQJ.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -137323 for 2084 contacts (-65.9/contact) +
2D Compatibility (PS) -28047 + (NN) -12834 + (LL) 1860
1D Compatibility (HY) -4800 + (ID) 1700
Total energy: -182844.0 ( -87.74 by residue)
QMean score : 0.537
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