Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MWITQEITPYLRKEYTIEAKLLDVRSEHNILEIFKSKDFGEIAMLNR--QLLFKNFLHIESELLAHMGGCTKKELREVLIVDGFDLELAHQLFKYDTRIDFVQA--DEKILDSFISFFPHFHEVKNNKNFT-HAK---QLLDLDIKKYDLILCLQEPDIHKIDGL---------KRMLKEDGVFISVAKHPLLEHVSMQNALKNLGDFFPITIPFVAPLRILSNKGYIYASFKTHPLKDL-------------------MTPKIEALKSVRYYNEDIHRAAFALPKNLQEVFKDNIKS |
3RW9 Chain:A ((47-302)) | ------------------------RSRYQDILVFRSKTYGNVLVLDGVIQCTERDEFSYQ-EMIANLPLCSHPNPRKVLIIGGGDGGVLREVVKHPSVESVVQCEIDEDVIQVSKKFLPGMAIGYSSSKLTLHVGDGFEFMKQNQDAFDVIITDS----GPAESLFKESYYQLMKTALKEDGVLCCQGECQWL-HLDL---IKEMRQFCQSLFPVVA---------YAYCTIPTYPSGQIGFMLCSKNPSTNFQEPVQPLTQQQVAQMQLKYYNSDVHRAAFVLPEFARKALND---- |
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General information:
TITO was launched using:
| RESULT:
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Template: 3RW9.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -119228 for 1661 contacts (-71.8/contact) +
2D Compatibility (PS) -22915 + (NN) -7203 + (LL) 3436
1D Compatibility (HY) -14800 + (ID) 3050
Total energy: -163760.0 ( -98.59 by residue)
QMean score : 0.437
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