Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MSQQHDYVIGKNAVIETLKSDRKLYKLWMAENTVKGQAQQVIELAKKQGITIQYVPRKKLDQMVTGQHQGVVAQVAAYEYAELDDLYKAAEEKNEQPFFLILDELEDPHNLGSIMRTADAVGAHGIVIPKRRAVGL-TTTVAKASTGAIEHIPVARVTN--LARTLEEMKERGIWVVGTDASAREDFRNMDGNMPLALVIGSEGKGMGRLVKEKCDFLIKLPMAGKVTSLNASVAAGLLMYEVYRKRNPVGE
4X3L Chain:B ((109-255))
------------------------------------------------------------------------------------------------PLVLVLLGLEKPGNLGAILRAADGAGADLVLVAE--GVDLFSPQVIRNSTGAVFALPVYPVAEGEAARFLEEHN---LPLVAATPEGERLYWEGDYRGGVAFLLGAEDKGLPEAWKRRAQVRVRIPMRGRADSLNVAVTAALLLYEALRQRS----
General information:
TITO was launched using:
RESULT:
Template:
4X3L.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -130716 for 1138 contacts (-114.9/contact) +
2D Compatibility (PS) -15972 + (NN) -7950 + (LL) 8764
1D Compatibility (HY) -12000 + (ID) 2600
Total energy: -160474.0 ( -141.01 by residue)
QMean score : 0.622
(partial model without unconserved sides chains):
PDB file :
Tito_4X3L.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-4X3L-query.scw
PDB file :
Tito_Scwrl_4X3L.pdb
: