Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MRNKKIPLRKCIITGERLPKGELLRIAYSKDGALTIDPTGKAPGRGFYIVKSVEACEKAKKKNAIFHQL-KMPEQESFYDELIAYVKSLEEPTNG
2IEC Chain:A ((14-50))
----------------------------------------------------RAIFEAGITLGAIYHQFCGTPVSPGTAEEVAKCIERA------
General information:
TITO was launched using:
RESULT:
Template:
2IEC.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -5683 for 152 contacts (-37.4/contact) +
2D Compatibility (PS) -3832 + (NN) -3796 + (LL) 2608
1D Compatibility (HY) -400 + (ID) 350
Total energy: -11453.0 ( -75.35 by residue)
QMean score : 0.638
(partial model without unconserved sides chains):
PDB file :
Tito_2IEC.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-2IEC-query.scw
PDB file :
Tito_Scwrl_2IEC.pdb
: