Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MSKLSVFFIFLFCSIATAAESLPDLKIEKLDEGVYVHTSFEEVNGWGVVPKHGLVVLVNAEAYLIDTPFTAKDTEKLVTWFVERGYKIKGSISSHFHSDSTGGIEWLNSRSIPTYASELTNELLKKDGKVQATNSFSGVNYWLVKNKIEVFYPGPGHTPDNVVVWLPERKILFGGCFIKPYGLGNLGDANIEAWPKSAKLLKSKYGKAKLVVPSHSEVGDASLLKLTLEQAVKGLNESKKPSKPSN
1WUP Chain:A ((4-220))
---------------------LPDLKIEKLDEGVYVHTSFEEVNGWGVVPKHGLVVLVNAEAYLIDTPFTAKDTEKLVTWFVERGYKIKGSISSHFHSESTGGIEWLNSRSIPTYASELTNELLKKDGKVQATNSFSGVNYWLVKNKIEVFYPGPGHTPDNVVVWLPERKILFGGCFIKPYGLGNLGDANIEAWPKSAKLLKSKYGKAKLVVPSHSEVGDASLLKLTLEQAVKGLNES--------
General information:
TITO was launched using:
RESULT:
Template:
1WUP.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -99016 for 2023 contacts (-48.9/contact) +
2D Compatibility (PS) -23979 + (NN) -15043 + (LL) 2060
1D Compatibility (HY) -31200 + (ID) 10800
Total energy: -177978.0 ( -87.98 by residue)
QMean score : 0.655
(partial model without unconserved sides chains):
PDB file :
Tito_1WUP.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-1WUP-query.scw
PDB file :
Tito_Scwrl_1WUP.pdb
: