Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MSITSTDICQAADALKGFVGFNRKTGRYIVRFSEDSFGMDVADDSITPTSEFVWSSVRDDVMRLGREQLQILLEQNINERLNIGEPLLVYLRRQDLPEITAQRQLR
2CRH Chain:A ((45-58))
----------------------RSDGTFLVRQRVKDAAEFAISIKYNVEVKHIKIMTAEGLYRITEKKAFRGLTELVEFYQQNSLKDCFKSLDTTLQFPFKEPEKR
General information:
TITO was launched using:
RESULT:
Template:
2CRH.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -451 for 31 contacts (-14.5/contact) +
2D Compatibility (PS) -1684 + (NN) -2892 + (LL) 1392
1D Compatibility (HY) -800 + (ID) 200
Total energy: -4635.0 ( -149.52 by residue)
QMean score : 0.180
(partial model without unconserved sides chains):
PDB file :
Tito_2CRH.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-2CRH-query.scw
PDB file :
Tito_Scwrl_2CRH.pdb
: