Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MRIRVPATTANLGPGFDSCGLALTLYLTLDIGAEADSWYIEHNIGGGIPHDETNVIIETALNLAPNLTPHHLVMTCDIPPARGLGSSSAAVVAGIELANTLAELNLSKEEKVRIAAEIEGHPDNVAPAVLGNWVVGAKLDGEDFYVRHLFPDCALIAFIPKAELLTSESRGVLPDTLPFKEAVQASSIANVMIAAILRNDMTLAGEMMERDLWHEKYRSQLVPHLAQIRDVAKNQGAYAACLSGAGPTVLVFAPRNLANKLQTSLQTLEIDADVLLLDVEGSGAEVFR
3HUL Chain:A ((3-290))
LRIRVPATTANLGPGFDSCGLALTLYLTLDIGAEADSWYIEHNIGGGIPHDETNVIIETALNLAPNLTPHHLVMTCDIPPARGLGSSSAAVVAGIELANTLAELNLSKEEKVRIAAEIEGHPDNVAPAVLGNWVVGAKLDGEDFYVRHLFP-CALIAFIPKAELL--------PDTLPFKEAVQASSIANVMIAAILRNDMTLAGEMMERDLW-----SQLVPHLAQIRDVAKNQGAYAACLSGAGPTVLVFAPRNLANKLQTSLQTLEIDADVLLLDVEGSGAEVFR
General information:
TITO was launched using:
RESULT:
Template:
3HUL.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -224645 for 2398 contacts (-93.7/contact) +
2D Compatibility (PS) -30060 + (NN) -12931 + (LL) 724
1D Compatibility (HY) -39200 + (ID) 13650
Total energy: -319762.0 ( -133.35 by residue)
QMean score : 0.556
(partial model without unconserved sides chains):
PDB file :
Tito_3HUL.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-3HUL-query.scw
PDB file :
Tito_Scwrl_3HUL.pdb
: