Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MSAIDKLVKASHLIDMNDIIREGNPTLRKVAEEVTFPLSEKEEI--LGEKMMQFLKHSQDPIMAEKLGLRGGVGLAAPQLDISKRIIAVLVPNVEDAQGNPPKEAYSLQEVMYNPKVVSHSVQDAALSDGEGCLSVDREVPGYVVRHARVTIEYFDKTGEKHRLKLKGYNSIVVQHEIDHIDGIMFYDRINEKNPFAVKEGLLILE
1VEY Chain:B ((5-169))
------------------ILRMGDPILRKISEPVTEDEIQTKEFKKLIRDMFDTMRHAE------------GVGLAAPQIGILKQIVVVGSEDNERYPGTPDVP----ERIILNP-VITPLTKDTS-GFWEGCLSVP-GMRGYVERPNQIRMQWMDEKGNQFDETIDGYKAIVYQHECDHLQGILYVDRLKDTKLFGFNETLDS--
General information:
TITO was launched using:
RESULT:
Template:
1VEY.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -55923 for 1258 contacts (-44.5/contact) +
2D Compatibility (PS) -17510 + (NN) -9633 + (LL) 3184
1D Compatibility (HY) -15200 + (ID) 3050
Total energy: -98132.0 ( -78.01 by residue)
QMean score : 0.490
(partial model without unconserved sides chains):
PDB file :
Tito_1VEY.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-1VEY-query.scw
PDB file :
Tito_Scwrl_1VEY.pdb
: