Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MRNELEDKILAILEQHQVGVLTSVQGDYPHARYMTFLHDGLTLYTPSGKELPKTDEVRRNPHVSVLIGYESPG--SAFLEINGLASLEEDESIKERIWENISKEWFRGEDSPSFVVIKIVPEQIRILNSDDDGPDTLDLIG
3EC6 Chain:A ((4-129))
----LKEKITTIIQGQRTGVLSTVRNDKPHSAFMMFFHEDFVLYVATDRQSKKITDIENNPNVHVLLGR---KLDEDYIEVEGLASIEEDSTLKNKFWNNSLKRWLLRPEDPNYVLIKINPDTI-----------------
General information:
TITO was launched using:
RESULT:
Template:
3EC6.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -54572 for 818 contacts (-66.7/contact) +
2D Compatibility (PS) -13009 + (NN) -7690 + (LL) 384
1D Compatibility (HY) -11200 + (ID) 2150
Total energy: -88237.0 ( -107.87 by residue)
QMean score : 0.410
(partial model without unconserved sides chains):
PDB file :
Tito_3EC6.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-3EC6-query.scw
PDB file :
Tito_Scwrl_3EC6.pdb
: