Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MNSKNTICLWYDSAALEAATFYAETFPDSAVLAVHRAPGDYPSGKEGDVLTVEFRVMGIPCLGLNGGPAFR-HSEAFSFQVATDDQAETDRLWNAIVDNGGE-------ESACGWCRDKWGISWQITPRVLSEAIASPDRAAARRAFEAMMTMGRIDIATIEKAFKG
1NKI Chain:A ((10-116))
--------LAVA-DLPASIAFYRDLLGFRLEAR-W---------D----QGAYLELGSLWLCLSREPQYGGPAADYTHYAFGI-AAADFARFAAQLRAHGVREWKQNRSEGDSFYFLDPDGHRLEAHVGDL------------------------------------
General information:
TITO was launched using:
RESULT:
Template:
1NKI.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -41900 for 654 contacts (-64.1/contact) +
2D Compatibility (PS) -10381 + (NN) -4013 + (LL) 3392
1D Compatibility (HY) -400 + (ID) 500
Total energy: -53802.0 ( -82.27 by residue)
QMean score : 0.267
(partial model without unconserved sides chains):
PDB file :
Tito_1NKI.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-1NKI-query.scw
PDB file :
Tito_Scwrl_1NKI.pdb
: