Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MTQGTVKWFNSEKGFGFISSETGTDVFAHFSEIKVDGFKTLEEGQKVTFDIQDGQRGPQATNINLVK
2ES2 Chain:A ((1-63))
MLEGKVKWFNSEKGFGFIEVEGQDDVFVHFSAIQGEGFKTLEEGQAVSFEIVEGNRGPQAANVTKEA
General information:
TITO was launched using:
RESULT:
Template:
2ES2.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -23551 for 416 contacts (-56.6/contact) +
2D Compatibility (PS) -6698 + (NN) -1790 + (LL) 0
1D Compatibility (HY) -6400 + (ID) 2100
Total energy: -40539.0 ( -97.45 by residue)
QMean score : 0.503
(partial model without unconserved sides chains):
PDB file :
Tito_2ES2.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-2ES2-query.scw
PDB file :
Tito_Scwrl_2ES2.pdb
: