Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MKINTTGGQIHGITQDGLDIFLGIPYAEPPVHDNRFKHSTLKTQWSEPIDATEIQPIPPQPDNKLEDFFSSQSTTFTEHEDCLYLNIWKQHNDQTKKPVIIYFYGGSFENGHGTAELYQPAHLVQNNDIIVITCNYRLGALGYLDWSYFNKDFHSNNGLSDQINVIKWVHQFIESFGGDANNITLMGQSAGSMSILTLLKIPDIEPYFHKVVLLSGALRLDTLK-SARNKAQYFQKMMRDYLDTDDVTSLSTDDILMLMAKLKQSRGPS-------KGLDLIYAPIKTD-YIQNDYPTTKPIFACYTKDEGDIYITSEQKKLSPQRFIDIME-LNDIPL--KYEDV--QTAKQQSLAITHCYFKQPMKQFLQHLNIQDSNAQLWLAEFAWHDTSSAHYRSAYHILDMVFWFGNL-QILAAHQYPTTAHLKFLSRQMQNDLANFAKSG-----KMPWPMYHNERRYYRTYQ |
1C7I Chain:A ((6-460)) | --VTTQYGKVKGTTENGVHKWKGIPYAKPPVGQWRFKAPEPPEVWEDVLDATVYGPVCPQPSDLLS---LSYKELPRQSEDCLYVNVFAPDTPSQNLPVMVWIHGGAFYLGAGSEPLYDGSKLAAQGEVIVVTLNYRLGPFGFMHLSSFDEAYSDNLGLLDQAAALKWVRENISAFGGDPDNVTVFGESAGGMSIAALLAMPAAKGLFQKAIMESGASRTMTKEQAASTAAAFLQVLGINESQLDRLHTVAAEDLLKAADQLRIAEKENIFQLFFQPALDPKTLPEEPEKSIAEGAASGIPLLIGTTRDEGYFFFTPDSDVYSQETLDAALEYLLGKPLAEKVADLYPRSLESQIHMVTDLLFWRPAVAF---ASAQSHYAPVWMYRFDWH-PEKPPYNKAFHTLELPFVFGNLDELERMAKAEITDEVKQLSHTIQSAWTTFAKTGNPSTEAVNWPAYHEESR------ |
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General information:
TITO was launched using:
| RESULT:
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Template: 1C7I.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -196152 for 3788 contacts (-51.8/contact) +
2D Compatibility (PS) -46677 + (NN) -26483 + (LL) 1272
1D Compatibility (HY) -25200 + (ID) 7200
Total energy: -300440.0 ( -79.31 by residue)
QMean score : 0.456
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