Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MRALLLSGCLALVLLTQQAAAQTLLVVGDSISAALGLDTSQGWVALLQKRLADEGYDYRV--------------VNASISGDTSAGGLARLPALLAEEKPALVVIELGGNDGLRGMAPAQLQQNLASMAQKARAE--GAKVLLLGIQLPPNYGPRYIEAFSRVYGAVAAQ-EKTALVPFFLEGVGGVQGMMQADGIHPALAAQPRLLENVWPTLKPLL
2VPT Chain:A ((4-198))
-------------------KTIKIMPVGDSCTEGMGGGEMGSYRTELYRLLTQAGLSIDFVGSQRSGPSSLPDKDHEGHSGWTIPQIASNINNWLNTHNPDVVFLWIGGNDLLLNG--NLNATGLSNLIDQIFTVKPNVTLFVADYYPWPEAIKQYNAVIPGIVQQKANAGKKVYFVKLSEIQF-DRNTDISWDGLHLSEIGYKKIANIWYKYTIDI-
General information:
TITO was launched using:
RESULT:
Template:
2VPT.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -93838 for 1468 contacts (-63.9/contact) +
2D Compatibility (PS) -19124 + (NN) -4025 + (LL) 2320
1D Compatibility (HY) -7600 + (ID) 1400
Total energy: -123667.0 ( -84.24 by residue)
QMean score : 0.505
(partial model without unconserved sides chains):
PDB file :
Tito_2VPT.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-2VPT-query.scw
PDB file :
Tito_Scwrl_2VPT.pdb
: