Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MDSKYQCVKLNDGHFMPVLGFGTYAPAEVPKSKALEATKLAIEAGFRHIDSAHLYNNEEQVGLAIRSKIAD---GSVKREDIFYTSKLWCNSHRPELVRPALERSLKNLQLDYVDLYLIHFPVSVKPGEE--VIPKDENGKILFDTVDLCATWEAVEKCKDAGLAKSIGVSNFNRRQLEMILNKPGLKYKPVCNQVECHPYFNQRKLLDFCKSKDIVLVAYSALGSHREEPWVDPNSPVLLEDPVLCALAKKHKRTPALIALRYQLQR----GVVVLAKSYNEQRIRQNVQVFEFQLTSEEMKAIDGLNRN--VRYLTLDIFAGPPNYPFSDEY |
3KRB Chain:A ((21-324)) | -----------SMQYPPRLGFGTWQA---PPEAVQTAVETALMTGYRHIDCAYVYQNEEAIGRAFGKIFKDASSG-IKREDVWITSKLWNYNHRPELVREQCKKTMSDLQVDYLDLFLVHWPLAFVRNDVGDLFPKDAEGRAMLEKVPLADTWRAMEQLVEEGLVKHIGVSNYTVPLLADLLNYAK--IKPLVNQIEIHPWHPNDATVKFCLDNGIGVTAYSPMGGSYA----TQ-KNVILECKTLKAIADAKGTSPHCVALAWHVKKWNTSMYSVIPKSQTPARIEANFKCTEVQLSDDDMDAINNIHLNKRIRFCDP--------------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 3KRB.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -169482 for 2430 contacts (-69.7/contact) +
2D Compatibility (PS) -31765 + (NN) -21259 + (LL) 1720
1D Compatibility (HY) -26800 + (ID) 5300
Total energy: -252886.0 ( -104.07 by residue)
QMean score : 0.666
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