Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MRNRLKELRARDGLNQTQLAKLAGVSRQTISLIERNNFMPSVLTAIKIARIFNETVETVFIIEEDEA
2XIU Chain:B ((4-61))
--NNLKLIREKKKISQSELAALLEVSRQTINGIEKNKYNPSLQLALKIAYYLNCPLEDIF-------
General information:
TITO was launched using:
RESULT:
Template:
2XIU.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -19943 for 382 contacts (-52.2/contact) +
2D Compatibility (PS) -6557 + (NN) -3353 + (LL) 1096
1D Compatibility (HY) -5600 + (ID) 1300
Total energy: -35657.0 ( -93.34 by residue)
QMean score : 0.830
(partial model without unconserved sides chains):
PDB file :
Tito_2XIU.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-2XIU-query.scw
PDB file :
Tito_Scwrl_2XIU.pdb
: