Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MGRIQRNKIKVEIKKLSHGKDLPLPCYATMQSAGMDLYAALGNSIVLNPLERLLIPTGIVIVIPNGFEGQIRPRSGLAAKYGITVLNSPGTIDSDYRGEVKVCLINLSNQPYEIKRGDRIAQILIAPVFRVIWDDAERLCTEETERSAGGFGSSGR
2OKD Chain:B ((22-131))
------------------------PTRQSPGAAGYDLYSAYDYTIP--PGERQLIKTDISMSMPKFCYGRIAPRSGLSLK-GIDI--GGGVIDEDYRGNIGVILINNGKCTFNVNTGDRIAQLIYQRIYYPELEEVQSL-----------------
General information:
TITO was launched using:
RESULT:
Template:
2OKD.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -55290 for 700 contacts (-79.0/contact) +
2D Compatibility (PS) -12306 + (NN) -6194 + (LL) 2120
1D Compatibility (HY) -8400 + (ID) 2200
Total energy: -82270.0 ( -117.53 by residue)
QMean score : 0.167
(partial model without unconserved sides chains):
PDB file :
Tito_2OKD.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-2OKD-query.scw
PDB file :
Tito_Scwrl_2OKD.pdb
: