Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MMKHDIEKVLISEEEIQKKVKELGAELTSEYQDTFPLAIGVLKGALPFMADLIKHIDTYLEMDFMDVSSYGNSTVSSGEVKIIKDLDTSVEGRDILIIEDIIDSGLTLSYLVELFRYRKAKSIKIVTLLDKPSGRKADIKADFVGFEVPDAFVVGYGLDYAERYRNLPYIGVLKPAVYES
3KB8 Chain:C ((25-203))
MMNQDIEKVLISEEQIQEKVLELGAIIAEDYKNTVPLAIGVLKGAMPFMADLLKRTDTYLEMDFMAVSSYGHSTVSTGEVKILKDLDTSVEGRDILIVEDIIDSGLTLSYLVDLFKYRKAKSVKIVTLLDKPTGRKVDLKADYVGFTVPHEFVVGYGLDYKEQYRNLPYVGVLKPSVYS-
General information:
TITO was launched using:
RESULT:
Template:
3KB8.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -139127 for 1393 contacts (-99.9/contact) +
2D Compatibility (PS) -19227 + (NN) -6369 + (LL) -28
1D Compatibility (HY) -28400 + (ID) 7100
Total energy: -200251.0 ( -143.76 by residue)
QMean score : 0.498
(partial model without unconserved sides chains):
PDB file :
Tito_3KB8.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-3KB8-query.scw
PDB file :
Tito_Scwrl_3KB8.pdb
: