Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MAEPDPSHPLETQAGKVQEAQDSDSDSEGGAAGGEADMDFLRNLFSQTLSLGSQKERLLDELTLEGVARYMQSERCRRVICLVGAGISTSAGIPDFRSPSTGLYDNLEKYHLPYPEAIFEISYFKKHPEPFFALAKELYPGQFKPTICHYFMRLLKDKGLLLRCYTQNIDTLERIAGLEQEDLVEAHGTFYTSHCVSASCRHEYPLSWMKEKIFSE---VTPKCEDCQSLVKPDIVFFGESLPARFFSCMQSD----------FLKVDLLLVMGTSLQVQPFASLISKAPLSTPRLLINKEKAGQSDPFLGMIMGLGGGMDFDSKKAYRDVAWLGECDQGCLALAELLGWKKELEDLVRREHASIDAQSGAGVPNPSTSASPKKSPPPAKDEARTTEREKPQ |
1Q1A Chain:A ((7-288)) | --------------------------------------------------------------SVRKIAAHMKSNPNAKVIFMVGAGISTSCGIPDFRSPGTGLYHNLARLKLPYPEAVFDVDFFQSDPLPFYTLAKELYPGNFRPSKFHYLLKLFQDKDVLKRVYTQNIDTLERQAGVKDDLIIEAHGSFAHCHCI--GCGKVYPPQVFKSKLAEHPIKDFVKCDVCGELVKPAIVFFGEDLPDSFSETWLNDSEWLREKITT-PQQPLVIVVGTSLAVYPFASLPEEIPRKVKRVLCNLETVGD----------------FKANKRPTDLIVHQYSDEFAEQLVEELGWQEDFEKILT------------------------------------------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 1Q1A.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -174923 for 2167 contacts (-80.7/contact) +
2D Compatibility (PS) -27969 + (NN) -11887 + (LL) 4016
1D Compatibility (HY) -24800 + (ID) 6200
Total energy: -241763.0 ( -111.57 by residue)
QMean score : 0.470
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