Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MPKVALYNQNGSTAGDIELNASVFGIEPNESVVFDAILMQRASLRQGTHKVKNRSEVRGGGRKPWRQKGTGRARQGSIRSPQWRGGGVVFGPTPRSYSYKLPKKVRRLAIKSVLSSKVIDNNIIVLEDLTLDTAKTKEMAAILKGLSVEKKALIVTADANEAVALSARNIPGVTVVEANGINVLDVVNHEKLLITKAAVEKVEEVLA
5ADY Chain:E ((12-201))
----------------LTVSETTFGRDFNEALVHQVVVAYAAGARQGTRAQKTRAEVTGSGKKPWRQKGTGRARSGSIKSPIWRSGGVTFAARPQDHSQKVNKKMYRGALKSILSELVRQDRLIVVEKFSVEAPKTKLLAQKLKDMALE-DVLIITGELDENLFLAARNLHKVDVRDATGIDPVSLIAFDKVVMTADAVKQVEEMLA
General information:
TITO was launched using:
RESULT:
Template:
5ADY.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -80513 for 1265 contacts (-63.6/contact) +
2D Compatibility (PS) -20674 + (NN) -10628 + (LL) 508
1D Compatibility (HY) -13600 + (ID) 4150
Total energy: -129057.0 ( -102.02 by residue)
QMean score : 0.511
(partial model without unconserved sides chains):
PDB file :
Tito_5ADY.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-5ADY-query.scw
PDB file :
Tito_Scwrl_5ADY.pdb
: