Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MTLLYEGKAKRIFSTNQENELRVEYKDEVTAGNGAKKDTMAGKGRLNNQITSIIFKYLQENGIESHFIKQLSETEQLVKPVKIIPLEVVVRNIASGSITKRLGFENGEVFREPLVEFFYKNDALNDPLITDDHVKLLNIASDEDIEILKSKALKINNVLKQLMDAMNLKLVDFKIEFGKTETGQILLADEISPDTCRIWDKATNANFDKDVYRNNTGSLIETYQIFLNKLEDLK
4NYE Chain:B ((25-254))
--LIYSGKAKDIYTTEDENLIISTYKDQATAFNGVKKEQIAGKGVLNNQISSFIFEKLNVAGVATHFVEKLSDTEQLNKKVKIIPLEVVLRNYTAGSFSKRFGVDEGIALETPIVEFYYKNDDLDDPFINDEHVKFLQIAGDQQIAYLKEETRRINELLKVWFAEIGLKLIDFKLEFGFDKDGKIILADEFSPDNCRLWDADGN-HMDKDVFRRGLGELTDVYEIVWEKLQEL-
General information:
TITO was launched using:
RESULT:
Template:
4NYE.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -73451 for 1808 contacts (-40.6/contact) +
2D Compatibility (PS) -24777 + (NN) -7041 + (LL) 468
1D Compatibility (HY) -27200 + (ID) 6050
Total energy: -138051.0 ( -76.36 by residue)
QMean score : 0.442
(partial model without unconserved sides chains):
PDB file :
Tito_4NYE.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-4NYE-query.scw
PDB file :
Tito_Scwrl_4NYE.pdb
: