Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MQTIKCVVVGDGAVGKTCLLISYTTNKFPSEYVPTVFDNYAVTVMIGGEPYTLGLFDTAGQEDYDRLRPLSYPQTDVFLVCFSVVSPSSFENVKEKWVPEITHHCPKTPFLLVGTQIDLRDDPSTIEKLAKNKQKP
2NGR Chain:A ((1-136))
MQTIKCVVVGDGAVGKTCLLISYTTNKFPSEYVPTVFDNYAVTVMIGGEPYTLGLFDTAGQEDYDRLRPLSYPQTDVFLVCFSVVSPSSFENVKEKWVPEITHHCPKTPFLLVGTQIDLRDDPSTIEKLAKNKQKP
General information:
TITO was launched using:
RESULT:
Template:
2NGR.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -58600 for 959 contacts (-61.1/contact) +
2D Compatibility (PS) -14868 + (NN) -7813 + (LL) 0
1D Compatibility (HY) -20800 + (ID) 6800
Total energy: -108881.0 ( -113.54 by residue)
QMean score : 0.463
(partial model without unconserved sides chains):
PDB file :
Tito_2NGR.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-2NGR-query.scw
PDB file :
Tito_Scwrl_2NGR.pdb
: