Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MQHLVLIGFMGSGKSSLAQELGLALKLEVLDTDMIISERVGLSVRGIFEELGEDNFRMFEKNLIDELKTLKTPHIISTGGGIVMHENLKGLGTTFYLKMDFETLIKRLNQKEREKRPLLNNLTQAKELFEKRQALYEKNASFIIDARGGLNNSLKQVLQFIA
3HR7 Chain:A ((7-168))
MQHLVLIGFMGSGKSSLAQELGLALKLEVLDTDMIISERVGLSVREIFEELGEDNFRMFEKNLIDELKTLKTPHVISTGGGIVMHENLKGLGTTFYLKMDFETLIKRLN-----------NLTQAKELFEKRQALYEKNASFIIDARGGLNNSLKQVLQFIA
General information:
TITO was launched using:
RESULT:
Template:
3HR7.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -93719 for 1131 contacts (-82.9/contact) +
2D Compatibility (PS) -16371 + (NN) -6015 + (LL) 788
1D Compatibility (HY) -23600 + (ID) 7450
Total energy: -146367.0 ( -129.41 by residue)
QMean score : 0.665
(partial model without unconserved sides chains):
PDB file :
Tito_3HR7.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-3HR7-query.scw
PDB file :
Tito_Scwrl_3HR7.pdb
: