Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MSVGEGPDTKPTARGQPAAVGRVVVLSGPSAVGKSTVVRCLRERIP--NLHFSVSATTRAPRPGEVDGVDYHFIDPTRFQQLIDQGELLEWAEIHGGLHRSGTLAQPVRAAAATGVPVLIEVDLAGARAIKKTMPEAVTVFLAPPSWQDLQARLIGRGTETADVIQRRLDTARIELAAQGDFDKVVVNRRLESACAELVSLLVGTAPGSP
2AN9 Chain:B ((2-183))
------------------AQGTLYIVSAPSGAGKSSLIQALLKTQPLYDTQVSVSHTTRQPRPGEVHGEHYFFVNHDEFKEMISRDAFLEHAEVFGNYY--GTSREAIEQVLATGVDVFLDIDWQGAQQIRQKMPHARSIFILPPSKIELDRRLRGRGQDSEEVIAKRMAQAVAEMSHYAEYDYLIVNDDFDTALTDLKTII--------
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) -98366 for 1330 contacts (-74.0/contact) +
2D Compatibility (PS) -20313 + (NN) -10544 + (LL) -52
1D Compatibility (HY) -13600 + (ID) 3300
Total energy: -146175.0 ( -109.91 by residue)
QMean score : 0.558
(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
: