Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MADCDSVTNSPLATATATLHTNRGDIKIALFGNHAPKTVANFVGLAQGTKDYSTQNASGGPSGPFYDGAVFHRVIQGFMIQGGDPTGT-GRGGPGYKFADEFHPELQFDKPYLLAMANA-GPGTNGSQFFITVGKTPHLN--------RRHTIFGEVIDAESQRVVEAISKTATDG----NDRPTDPVVIESITIS
1LOP Chain:A ((2-163))
----------------VTFHTNHGDIVIKTFDDKAPETVKNFLDYCR---------------EGFYNNTIFHRVINGFMIQGGGFEPGMKQKATKEPIKNEANNGLKN-TRGTLAMARTQAPHSATAQFFINVVDNDFLNFSGESLQGWGYCVFAEVVD--GMDEVDKIKGVATGRSGMHQDVPKEDVIIESVTVS
General information:
TITO was launched using:
RESULT:
Template:
1LOP.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -79906 for 1174 contacts (-68.1/contact) +
2D Compatibility (PS) -15624 + (NN) -9592 + (LL) 592
1D Compatibility (HY) -12000 + (ID) 2950
Total energy: -119480.0 ( -101.77 by residue)
QMean score : 0.518
(partial model without unconserved sides chains):
PDB file :
Tito_1LOP.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-1LOP-query.scw
PDB file :
Tito_Scwrl_1LOP.pdb
: