Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MRQTMTFIPTLKEVPADAEVKSHQLLLRAGFIRQ--TASGIYSYLPLATLMLRKIETIIREELEAIGAAELLMPALQPAELWQ-ESGRWNDYGPELMRLKDR----ASRDFALGPTHEEVITALLRDEVKSYKRLPLTLYQIQTKFRDEKRPRFGLLRGREFIMKDAYSFHATSESLDEVYNLMHQAYSNIFT-RCGLEFRSVIADSGSIGGNESKEFMALSDIGEDTIAYSDASDYAANTEMAPVLYMEKKSHELEKDLEKVATPDQKSITDIVGFLEVPIEKTMKSMLYQVDDEVIMVLVRGDHEVNDIKIKNALDATNVELVDPAVAVELLGANFGSLGPINVPENMRVFADNAVKDIVNAVVGANEDGFHYINVNPDRDFSVTSYFDLRMIQVGDLSPDGQGVIKFAEGIEVGHIFKLGTKYSEAMNATILDENGRAQPIIMGCYGIGVSRILSAIAEQSNDENGFVWDKQISPFDLHLIPVNMKSE-------EQVAFAETLYTSLQD-AGFSVLIDDR-AERAGVKFADADLIGLPIRITVGKK-AAEGVVEVKIRKTGE--MIEVRQDELLNTLPILFGDK |
3IAL Chain:A ((30-408)) | -----------------------AIMDAAELVDRRYPVKGCVVFRPYGFFMENAIMRLCEEEYAKVGISQILFPTVIPESFLKKESDHIKGFEAECFWVEKGGLQPLEERLALRPTSETAIYSMFSKWVRSYKDLPLKIHQTCTIFRHETKNTKPLIRVREIHWNEAHCCHATAEDAVSQLSDYWKVIDTIFSDELCFKGQK------------------------------------------------------------LRRV--------------------------------------------------CW----------D--RFPG---ADYSEV---------------------------------------SD------V-------VMP-C------GRVLQTAGIHNLGQRFSSTFDILYANKANESVHPYLTCAGIS-TRVLACALSIHGDSGGLVLPPLIAPIHVVIIPIGCGKKNNQESDQQVLGKVNEIADTLKSKLGLRVSIDDDFSKSMGDKLYYYELKGVPLRIEVGQRDLANGQCIVVPRDVGKDQKRVIPITEVM---------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 3IAL.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -188870 for 2813 contacts (-67.1/contact) +
2D Compatibility (PS) -38006 + (NN) -9439 + (LL) 14748
1D Compatibility (HY) -25600 + (ID) 4100
Total energy: -251267.0 ( -89.32 by residue)
QMean score : 0.472
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