Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MQGHPEVIDYLNTLLTGELAARDQYFIHSRMYEDWGFSKLYERLNHEMEEETQHADALLRRILLLEGTPRMRPDDIHPGTTVPEMLEADLKLERHVRAALAKGIALCEQHKDFVSRDILKAQLADTEEDHAYWLEQQLGLIARMGLENYLQSQI
3R2H Chain:A ((1-154))
MQGHPEVIDYLNTLLTGELAARDQYFIHSRMYEDWGFSKLYERLNHEMEEETQHADALLRRILLLEGTPRMRPDDIHPGTTVPEMLEADLKLERHVRAALAKGIALCEQHKDFVSRDILKAQLADTEEDHAYWLEQQLGLIARMGLENYLQSQI
General information:
TITO was launched using:
RESULT:
Template:
3R2H.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -44093 for 1200 contacts (-36.7/contact) +
2D Compatibility (PS) -17062 + (NN) -11190 + (LL) 0
1D Compatibility (HY) -21200 + (ID) 7700
Total energy: -101245.0 ( -84.37 by residue)
QMean score : 0.630
(partial model without unconserved sides chains):
PDB file :
Tito_3R2H.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-3R2H-query.scw
PDB file :
Tito_Scwrl_3R2H.pdb
: