Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MFEKIRKILADIEDSQNEIEMLLKLANLSLGDFIEIKRGSMDMPKGVNEAFFTQLSEEVERLKELINALNKIKKGLLVF
4WLS Chain:A ((84-111))
TLEKVAEIERHIEELQSMRDQLLALANA---------------------------------------------------
General information:
TITO was launched using:
RESULT:
Template:
4WLS.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -3545 for 96 contacts (-36.9/contact) +
2D Compatibility (PS) -3015 + (NN) -2712 + (LL) 3976
1D Compatibility (HY) -400 + (ID) 350
Total energy: -6046.0 ( -62.98 by residue)
QMean score : 0.545
(partial model without unconserved sides chains):
PDB file :
Tito_4WLS.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-4WLS-query.scw
PDB file :
Tito_Scwrl_4WLS.pdb
: