Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
---------------------MLELAILGLLIESPMHGYELRKRLTGLLGAFRAFSYGSLYPALRRMQADGLIAENAAPAGTPVRRARRVYQLTDKGRRRFGELVADTGPHNYTDDGFGVHLAFFNRTPAEARMRILEGRRRQVEERREGLREAVARASSSFDRYTRQLHQLGLESSEREVKWLNELIAAERAAPNPAEQT
2E1N Chain:A ((13-122))
MDFEDIYRFFQDPPPHYLSKELAVCYVLAVLRHEDSYGTELIQHLETHWPNYR-LSDTVLYTALKFLEDEQIISGYWKKVEGRGRP-RRMYQLAQANDDRSRDLAQLWERYL-----------------------------------------------------------------------------------------
General information:
TITO was launched using:
RESULT:
Template:
2E1N.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -59773 for 586 contacts (-102.0/contact) +
2D Compatibility (PS) -9627 + (NN) -3633 + (LL) 7132
1D Compatibility (HY) -4800 + (ID) 1050
Total energy: -71751.0 ( -122.44 by residue)
QMean score : 0.447
(partial model without unconserved sides chains):
PDB file :
Tito_2E1N.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-2E1N-query.scw
PDB file :
Tito_Scwrl_2E1N.pdb
: