Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MKIFICEDDPKQRENMVTIIKNYIMIEEKPMEIALATDNPYEVLEQAKNMNDIGCYFLDIQLSTDINGIKLGSEIRKHDPVGNIIFVTSHSELTYLTFVYKVAAMDFIFKDDPAELRTRIIDCLETAHTRLQLLSKDNSVETIELKRGSNSVYVQYDDIMFFESSTKSHRLIAHLDNRQIEFYGNLKELSQLDDRFFRCHNSFVVNRHNIESIDSKERIVYFKNKEHCYASVRNVKKI
3BS1 Chain:A ((2-103))
----------------------------------------------------------------------------------------------------------------------------------------DNSVETIELKRGSNSVYVQYDDIMFFESSTKSHRLIAHLDNRQIEFYGNLKELSQLDDRFFRCHNSFVVNRHNIESIDSKERIVYFKNKEHCYASVRNVKKI
General information:
TITO was launched using:
RESULT:
Template:
3BS1.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -63481 for 724 contacts (-87.7/contact) +
2D Compatibility (PS) -10951 + (NN) -2980 + (LL) 10848
1D Compatibility (HY) -14800 + (ID) 5100
Total energy: -86464.0 ( -119.43 by residue)
QMean score : 0.528
(partial model without unconserved sides chains):
PDB file :
Tito_3BS1.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-3BS1-query.scw
PDB file :
Tito_Scwrl_3BS1.pdb
: