Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MCKYKAIIFDMDGVLFDTELFYYKRRERFLKQHGITIDHLPMNFFIGGNMKQVWKSVLGDQYDTWDIDKLQQDYSRYKEDNPLPYKDLIFQDCKRVIEKLHHKGYLLGLASSSTRHDIMLALESFNLDTYFKVILSGEEFSESKPNPAIYNRAAELLDIPKQQILIVEDSEKGITAGIAAGIDVWAIEDKYFGMNQSQANVLVSDLSQFFVKLDNY
3E58 Chain:A ((6-208))
----EAIIFDMDGVLFDTEKYYYDRRASFLGQKGISIDHLPPSFFIGGNTKQVWENILRDEYDKWDVSTLQEEYNTYKQNNPLPYKELIFPDVLKVLNEVKSQGLEIGLASSSVKADIFRALEENRLQGFFDIVLSGEEFKESKPNPEIYLTALKQLNVQASRALIIEDSEKGIAAGVAADVEVWAIRDNEFGMDQSAAKGLLDSLTDVLDLI---
General information:
TITO was launched using:
RESULT:
Template:
3E58.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -120780 for 1674 contacts (-72.2/contact) +
2D Compatibility (PS) -22125 + (NN) -13575 + (LL) 804
1D Compatibility (HY) -23200 + (ID) 5800
Total energy: -184676.0 ( -110.32 by residue)
QMean score : 0.613
(partial model without unconserved sides chains):
PDB file :
Tito_3E58.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-3E58-query.scw
PDB file :
Tito_Scwrl_3E58.pdb
: