Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | -MTLSEPVRRCPRNGKRIAREPGDRPGTFRLIHPRWAGASVKRAVRACSSCVLLCHAHANPEGTHHVQQHPGARQLHHLPVEATEPGHRRRPARRAAGLFRRFLAHRRGTQRRPRYPAQLRLPLPLSREGTRMIKRIAQTAGFAGLLAALLLTLLQILWVTPLILEAETYEKSEPVAAQPHEHAPGVAAHVHDEEAWEPEDGWQRTLSTTGGNLVVAVGFALMLAGLFTLRAPGQTWQGLLW--GLAGYAVFCLAPSLGLPPELPGTA---AADLVQRQYWWIATAAATAVGLALLVFGGNWPLKLVGAVLLALPHLFGAPQPEVHASLAPEALAQRFVVASLVSNALFWAALGLAAAWLFRRNRGGVDA |
2HBV Chain:A ((3-333)) | KPRIDMHSHFFPRISEQEAAKFDANHAPWLQVSAKGDTGSIMMGKNNFRPVYQALWD--PAFRIEEMDAQGVDVQVTCATPVMFGYTWEANKAAQWAERMNDFALEFAA-HNPQRIKVLAQVPLQDLDLACKEASRAVAA-GHLGIQIGNHLGDKDL-----------DDATLEAFLTHCANEDIPILVHPWDMMGGQRMKKWMLPWLVAMPAETQLAILSLILSGAFE-RIPKSLKICFGHGGGSFAFLLGRVDNAWRHRDIVREDCPRPPSEYVDRFFVDSAVFNPGALELLVSVMG-------EDRVMLGSDYPFPLGEQKIGGLVLSSNLGESAKDKIISGNASKFFNIN---------------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 2HBV.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -178009 for 2770 contacts (-64.3/contact) +
2D Compatibility (PS) -33681 + (NN) -5736 + (LL) 3292
1D Compatibility (HY) -1200 + (ID) 1950
Total energy: -217284.0 ( -78.44 by residue)
QMean score : 0.201
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