Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MQGHPEVIDYLNTLLTGELAARDQYFIHSRMYEDWGFSKLYERLNHEMEEETQHADALLRRILLLEGTPRMRPDDIHPGTTVPEMLEADLKLERHVRAALAKGIALCEQHKDFVSRDILKAQLADTEEDHAYWLEQQLGLIARMGLENYLQSQI
3R2S Chain:A ((1-154))
MQGHPEVIDYLNTLLTGELAARDQYFIHSRMYEDWGFSKLYERLNHEMEEETQHADALLRRILLLEGTPRMRPDDIHPGTTVPEMLEADLKLERHVRAALAKGIALCEQHKDFVSRDILKAQLADTEEDHAYWLEQQLGLIARMGLENYLQSQI
General information:
TITO was launched using:
RESULT:
Template:
3R2S.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -43326 for 1193 contacts (-36.3/contact) +
2D Compatibility (PS) -17074 + (NN) -10899 + (LL) 0
1D Compatibility (HY) -21200 + (ID) 7700
Total energy: -100199.0 ( -83.99 by residue)
QMean score : 0.668
(partial model without unconserved sides chains):
PDB file :
Tito_3R2S.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-3R2S-query.scw
PDB file :
Tito_Scwrl_3R2S.pdb
: