Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MPKLSIVVAPDERLTTRASEVTGINDKIKELVNDMFETMYNAEGLGLAAVQIGVLKRIFVMDIQLEDIKGEPVGYESTGKFCMINPEITELSDEQVILKEGCLSIPEQSHEIRRPKYLTVKYKDLNNKEQTLKASGWLARCIQHELDHLNGILYIRHLSKLKYDMAMKKAEKFKRHYER
1VEZ Chain:B ((29-161))
--------------------------EFKKLIRDMFDTMRHAEGVGLAAPQIGILKQIVV--VGSEDNERYP-GTPDVPERIILNPVITPLTKDTSGFWEGCLSVPGMRGYVERPNQIRMQWMDEKGNQFDETIDGYKAIVYQHECDHLQGILYVDRLKDTKLFGFNETLDS-------
General information:
TITO was launched using:
RESULT:
Template:
1VEZ.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -80608 for 1001 contacts (-80.5/contact) +
2D Compatibility (PS) -14160 + (NN) 495 + (LL) 2748
1D Compatibility (HY) -10000 + (ID) 2650
Total energy: -104175.0 ( -104.07 by residue)
QMean score : 0.346
(partial model without unconserved sides chains):
PDB file :
Tito_1VEZ.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-1VEZ-query.scw
PDB file :
Tito_Scwrl_1VEZ.pdb
: