Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MHEYSVVSSLIALCEEHAKKNQAHKIERVVVGIGERSAMDKSL----FVSAFETFREESLVCKDAILDIVDEKVELECKDCSHVFKPNALDYGVCEKCHSKNVIITQGNEMRLLSLEMLAE
1NDW Chain:A ((50-92))
-------------------------------------GMDKPLTLPDFLAKFDYYMPAIAGCRDAIKRIAYEFVEMKAKDGVVYVEVRYSPHLLANSKVEPIPWNQAEGDLTPDEVVSLVN
General information:
TITO was launched using:
RESULT:
Template:
1NDW.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -2142 for 155 contacts (-13.8/contact) +
2D Compatibility (PS) -4086 + (NN) -734 + (LL) 3340
1D Compatibility (HY) -2400 + (ID) 800
Total energy: -6822.0 ( -44.01 by residue)
QMean score : 0.335
(partial model without unconserved sides chains):
PDB file :
Tito_1NDW.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-1NDW-query.scw
PDB file :
Tito_Scwrl_1NDW.pdb
: