Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MSRDEVFEKMLELLRQQLGDPQLDITPESSLHDDLAIDSIALTEFIINLEDVFHLEIPDEAVEHMSSVQQLLDYIIEHK
3EJE Chain:G ((25-92))
-------ERVKKIIGEQLGVKQEEVTNNASFVEDLGADSLDTVELVMALEEEFDTEIPDEEAEKITTVQAAIDYI----
General information:
TITO was launched using:
RESULT:
Template:
3EJE.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -49095 for 442 contacts (-111.1/contact) +
2D Compatibility (PS) -7471 + (NN) -7185 + (LL) 1048
1D Compatibility (HY) -4400 + (ID) 1300
Total energy: -68403.0 ( -154.76 by residue)
QMean score : 0.683
(partial model without unconserved sides chains):
PDB file :
Tito_3EJE.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-3EJE-query.scw
PDB file :
Tito_Scwrl_3EJE.pdb
: