Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MAPKAVLVGLPGSGKSTIGRRLAKALGVGLLDTDVAIEQRTGRSIADIFATDGEQEFRRIEEDVVRAALADHDGVLSLGGGAVTSPGVRAALAGHTVVYLEISAAEGVRRTGGNTVRPLLAGPDRAEKYRALMAKRAPLYRRVATMRVDTNRRNPGAVVRHILSRLQVPSPSEAAT
2IYX Chain:A ((2-170))
-APKAVLVGLPGSGKSTIGRRLAKALGVGLLDTDVAIEQRTGRSIADIFATDGEQEFRRIEEDVVRAALADHDGVLSLGGGAVTSPGVRAALAGHTVVYLEISAAEGVRRTGGNTVRPLLAGPDRAEKYRALMAKRAPLYRRVATMRVDTNRRNPGAVVRHILSRLQVPS------
General information:
TITO was launched using:
RESULT:
Template:
2IYX.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -94638 for 1354 contacts (-69.9/contact) +
2D Compatibility (PS) -19079 + (NN) -10222 + (LL) 484
1D Compatibility (HY) -19600 + (ID) 8450
Total energy: -151505.0 ( -111.89 by residue)
QMean score : 0.862
(partial model without unconserved sides chains):
PDB file :
Tito_2IYX.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-2IYX-query.scw
PDB file :
Tito_Scwrl_2IYX.pdb
: