Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MLELAILGLLIESPMHGYELRKRLTGLLGAFRAFSYGSLYPALRRMQADGLIAENAAPAGTPVRRARRVYQLTDKGRRRFGELVADTGPHNYTDDGFGVHLAFFNRTPAEARMRILEGRRRQVEERREGLREAVARASSSFDRYTRQLHQLGLESSEREVKWLNELIAAERAAPNPAEQT
4ESB Chain:A ((9-92))
VLEGCILYIISQEEVYGYELSTKLNK--HGFTFVSEGSIYPLLLRMQKEKLI--EGTLKASSLGPKRKYYHITDKGLEQLEEFKQSWG--------------------------------------------------------------------------------------------
General information:
TITO was launched using:
RESULT:
Template:
4ESB.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -53978 for 542 contacts (-99.6/contact) +
2D Compatibility (PS) -9063 + (NN) -1469 + (LL) 7268
1D Compatibility (HY) -8000 + (ID) 1450
Total energy: -66692.0 ( -123.05 by residue)
QMean score : 0.506
(partial model without unconserved sides chains):
PDB file :
Tito_4ESB.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-4ESB-query.scw
PDB file :
Tito_Scwrl_4ESB.pdb
: