Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MCTARTAEEIFVETIAVKTRILNDRVLLEAARAIGDRLIAGYRAGARVFMCGNGGSAADAQHFAAELTGHLIFDRPPLGAEALHANSSHLTAVANDYDYDTVFARALEGSARPGDTLFAISTSGNSMSVLRAAKTARELGVTVVAMTGESGGQLAEFADFLINVPSRDTG-RIQESHIVFIHAISEHVEHALFAPRQ
2I22 Chain:B ((61-210))
-----------------------------------------FKAGGKVLSCGNGGSHCDAMHFAEELTGRYRENRPGYPAIAI-S--------------NDIFSRYVEAVGREGDVLLGISTSGNSANVIKAIAAAREKGMKVITLTGKDGGKMAGTADIEIRVPHFGYADRIQEIHIKVIHILIQLIEKEM-----
General information:
TITO was launched using:
RESULT:
Template:
2I22.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -94412 for 1126 contacts (-83.8/contact) +
2D Compatibility (PS) -15052 + (NN) -12021 + (LL) 5284
1D Compatibility (HY) -9600 + (ID) 3100
Total energy: -128901.0 ( -114.48 by residue)
QMean score : 0.569
(partial model without unconserved sides chains):
PDB file :
Tito_2I22.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-2I22-query.scw
PDB file :
Tito_Scwrl_2I22.pdb
: