Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MPNFAGTWKMRSSENFDELLKALGVNAMLRKVAVAAASKPHVEIRQDGDQFYIKTSTTVRTTEINFKVGEGFEEETVDGRKCRSLPTWENENKIHCTQTLLEGDGPKTYWTRELAND-ELILTFGADDVVCTRIYVRE
3FEL Chain:B ((1-137))
-PNFSGNWKIIRSENFEELLKVLGVNVMLRKIAVAAASKPAVEIKQEGDTFYIKESTTVRTTEINFKVGEEFEEQTVDGRPCKSLVKWESENKMVCEQKLLKGEGPKTSWTLELTNDGELILTMTADDVVCTKVYVRE
General information:
TITO was launched using:
RESULT:
Template:
3FEL.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -35692 for 947 contacts (-37.7/contact) +
2D Compatibility (PS) -15379 + (NN) -7438 + (LL) 208
1D Compatibility (HY) -16400 + (ID) 5100
Total energy: -79801.0 ( -84.27 by residue)
QMean score : 0.528
(partial model without unconserved sides chains):
PDB file :
Tito_3FEL.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-3FEL-query.scw
PDB file :
Tito_Scwrl_3FEL.pdb
: