Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MKNISDIIEAYLKQVLESSEAVEIKRSEIADKFECVPSQINYVINTRFTMERGYIVESKRGGGGYIRIIKVKMNDKLQLLEAIISMVHDKKVSQSFSEDVILRLLEEEVITKKEARLMVAALDREVLILPLPDRDILRSRILEAMLVALKYD
2HEO Chain:A ((14-57))
----------KILQVLSDDGG-PVAIFQLVKKCQVPKKTLNQVLY-RLK-KEDRVSS-----------------------------------------------------------------------------------------------
General information:
TITO was launched using:
RESULT:
Template:
2HEO.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -28017 for 243 contacts (-115.3/contact) +
2D Compatibility (PS) -4376 + (NN) 2376 + (LL) 10424
1D Compatibility (HY) -2800 + (ID) 350
Total energy: -22743.0 ( -93.59 by residue)
QMean score : 0.678
(partial model without unconserved sides chains):
PDB file :
Tito_2HEO.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-2HEO-query.scw
PDB file :
Tito_Scwrl_2HEO.pdb
: