Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MIQAYLGLGSNIGDRESQLNDAIKILNEYDGISVSNISPIYETAPVGYTEQPNFLNLCVEIQTTLTVLQLLECCLKTEECLHRIRK-ERWGPRTLDVDILLYGEEMIDLPKLSVPHPRMNERAFVLIPLNDIAANVVEPRSKLKVKDLVFVDDSVKRYK
3HSD Chain:B ((3-142))
---AYIAIGSNLASPLEQVNAALKALGDIPESHILTVSSFYRTPPLGPQDQPDALNAAVALETSLAPEELLNHTQRIELQQGRVRKAERWGPRTLDLDIMLFGNEVINTERLTVPHYDMKNRGFMLWPLFEIAPELVFPDGEM----------------
General information:
TITO was launched using:
RESULT:
Template:
3HSD.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -104089 for 1026 contacts (-101.5/contact) +
2D Compatibility (PS) -14399 + (NN) -4420 + (LL) 1800
1D Compatibility (HY) -10800 + (ID) 2850
Total energy: -134758.0 ( -131.34 by residue)
QMean score : 0.550
(partial model without unconserved sides chains):
PDB file :
Tito_3HSD.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-3HSD-query.scw
PDB file :
Tito_Scwrl_3HSD.pdb
: