Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MFRTMMNGKIHRATVTEANLNYVGSITIDSAILEAVDMLPNEKVQIVNNNNGARIETYIIPGEPGSGVICLNGAAARHVQVGDVVIIMSYGMFTDEEAKTHEPKIVVLDEKNHIEMILPEEKAHTTL
2C45 Chain:A ((1-112))
MLRTMLKSKIHRATVTCADLHYVGSVTIDADLMDAADLLEGEQVTIVDIDNGARLVTYAITGERGSGVIGINGAAAHLVHPGDLVILIAYATMDDARARTYQPRIVFVDAYN---------------
General information:
TITO was launched using:
RESULT:
Template:
2C45.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -65278 for 854 contacts (-76.4/contact) +
2D Compatibility (PS) -12379 + (NN) -6582 + (LL) 1540
1D Compatibility (HY) -12400 + (ID) 3050
Total energy: -98149.0 ( -114.93 by residue)
QMean score : 0.642
(partial model without unconserved sides chains):
PDB file :
Tito_2C45.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-2C45-query.scw
PDB file :
Tito_Scwrl_2C45.pdb
: