Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MNNDFNLLILSGPSGAGKSTLTKYLQEKIP--KTHFSLSTTTRKPREGEVDGLHYNFVSEEEFKQGIEKGQFLEWAIVHNHYYGTSKIPVEKALKEGKIVIFDIDVQGHEILKKHYPNACSVFISTKNQEILKERLLLRGTDSKETIEKRLINAYKEMQCLESFDYLIINEDLEKSKEIILSIAKTLVHRLKAFNFEKICKAWKNESL
2AN9 Chain:B ((5-175))
-----TLYIVSAPSGAGKSSLIQALLKTQPLYDTQVSVSHTTRQPRPGEVHGEHYFFVNHDEFKEMISRDAFLEHAEVFGNYYGTSREAIEQVLATGVDVFLDIDWQGAQQIRQKMPHARSIFILPPSKIELDRRLRGRGQDSEEVIAKRMAQAVAEMSHYAEYDYLIVNDDFDTALTDLKTIIRAERLRMSRQKQRHDALISKLLA-
General information:
TITO was launched using:
RESULT:
Template:
2AN9.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -44062 for 1212 contacts (-36.4/contact) +
2D Compatibility (PS) -18990 + (NN) -11397 + (LL) 168
1D Compatibility (HY) -12000 + (ID) 3850
Total energy: -90131.0 ( -74.37 by residue)
QMean score : 0.595
(partial model without unconserved sides chains):
PDB file :
Tito_2AN9.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-2AN9-query.scw
PDB file :
Tito_Scwrl_2AN9.pdb
: