Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MTIRSYQGKTPLLGERVFVDPSAVLVGDIEIGADSSVWPLVVIRGDMHRIRIGQRSSIQDGSVLHITHAGPFNPDGFPLSIGDEVTVGHKVLLHGCSIGNRVLVGMGSIVMDGAVIEDEVILGAGSLVPPGKVLESGFLYVGSPAKKARPLSDKERGFFAYTAGNYVKLKDLHIAEDYHA
3TIS Chain:B ((4-177))
--LHPYRDLFPQIGQRVMIDDSSVVIGDVRLADDVGIWPLVVIRGDVHYVQIGARTNIQDGSMLHVTHKSSYNPDGNPLTIGEDVTVGHKVMLHGCTIGNRVLVGMGSILLDGAIVEDDVMIGAGSLVPQNKRLESGYLYLGSPVKQIRPLSDEEKAGLRYSANNYVKWKDEYLDQ----
General information:
TITO was launched using:
RESULT:
Template:
3TIS.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -136143 for 1437 contacts (-94.7/contact) +
2D Compatibility (PS) -19389 + (NN) -12062 + (LL) 464
1D Compatibility (HY) -22000 + (ID) 5100
Total energy: -194230.0 ( -135.16 by residue)
QMean score : 0.528
(partial model without unconserved sides chains):
PDB file :
Tito_3TIS.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-3TIS-query.scw
PDB file :
Tito_Scwrl_3TIS.pdb
: