Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MTERGLLIVLSGPSGVGKGTVREAVFK-DPETSFDYSISMTTRLPREGEQDGVDYYFRSREVFEQAIKDGKMLEYAEYVGNYYGTPLEYVEEKLAAGVDIFLEIEVQGAMQVRKAMPEGIFIFLTPPDLSELKNRIIGRGTESMEVVEERMETAKKEIEMMASYDYAVVNDVVANAVQKIKGIVETEHLKTERVIHRYKKMLEGLQ
2ANB Chain:A ((3-204))
---QGTLYIVSAPSGAGKSSLIQALLKTQPLYDTQVSVSHTTRQPRPGEVHGEHYFFVNHDEFKEMISRDAFLEHAEVFGNYYGTSREAIEQVLATGVDVFLDIDWQGAQQIRQKMPHARSIFILPPSKIELDRRLRGRGQDSEEVIAKRMAQAVAEMSHYAEYDYLIVNDDFDTALTDLKTIIRAERLRMSRQKQRHDALISKL-
General information:
TITO was launched using:
RESULT:
Template:
2ANB.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -66512 for 1489 contacts (-44.7/contact) +
2D Compatibility (PS) -22085 + (NN) -13258 + (LL) 484
1D Compatibility (HY) -12800 + (ID) 4200
Total energy: -118371.0 ( -79.50 by residue)
QMean score : 0.508
(partial model without unconserved sides chains):
PDB file :
Tito_2ANB.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-2ANB-query.scw
PDB file :
Tito_Scwrl_2ANB.pdb
: