Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MRAKMKDIYLDVEKSIKDLQSIFKNADGRDEKLKRFNQEALEVFQKLERESLKELESLKNNEEWENFTIAFYGETGAGKSTLIECLRMFFKEQSKVDQQERFKR--LYSTYQYNHQNFILLDVPGIEGSEKKVIDQISNATQKAHAIFMLPKRLILRKKEKKGKGERLKKSKNSLIRKQRYGRFSTNRLIAQEP
4DCT Chain:A ((181-253))
-------------------------------------------------EHFKNIPETKYNEEVIQFCL--IGRPNVGKSSLVNA--MLGEERVIVSN------DAVDTSFTYNQQEFVIVDTAGMRKKGKVYETTEKYSVLRALKAIDRSEVVAVVLDGEEGIIEQDKRIAGYAHEAGKAVVIVVNKWDAVDK
General information:
TITO was launched using:
RESULT:
Template:
4DCT.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -24441 for 325 contacts (-75.2/contact) +
2D Compatibility (PS) -6861 + (NN) -1041 + (LL) 5408
1D Compatibility (HY) -5600 + (ID) 1050
Total energy: -33585.0 ( -103.34 by residue)
QMean score : 0.366
(partial model without unconserved sides chains):
PDB file :
Tito_4DCT.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-4DCT-query.scw
PDB file :
Tito_Scwrl_4DCT.pdb
: