Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MLQQYERVLVAVDGSKEAERAFQKAIQVANRNDAALGLVHVIDTRAFSSVA--NYDTSMADKATEYADELLSGYKEDALKAGVTKVESYIEYGSPKTAITKEAAKAF-QADLIMCGATGLNAVERLLIGSVSEYIIRHSPCDVLVVRNEVPDYKDEK
3S3T Chain:A ((3-146))
--ARYTNILVPVDSSDAAQAAFTEAVNIAQRHQANLTALYVVDDSAYHTPALDPVLSELLDAEAAHAKDAMRQRQQFVATTSAPNLKTEISYGIPKHTIEDYAKQ-HPEIDLIVLGATGTNSPHRVAVGSTTSYVVDHAPCNVIVIR----------
General information:
TITO was launched using:
RESULT:
Template:
3S3T.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -72494 for 1079 contacts (-67.2/contact) +
2D Compatibility (PS) -15432 + (NN) -3436 + (LL) 776
1D Compatibility (HY) -8400 + (ID) 2250
Total energy: -101236.0 ( -93.82 by residue)
QMean score : 0.489
(partial model without unconserved sides chains):
PDB file :
Tito_3S3T.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-3S3T-query.scw
PDB file :
Tito_Scwrl_3S3T.pdb
: