Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MVATLIIIRGNSASGKSKIAKQLQAELGENTLLLSQDYLRREMLGTKDG----------ENT-----TTIPLLINLLNYGYHNCSYIILEGILRSDWYTPVWKHILKHNPNNTYAYYYDLSFQETVKRHSTRLKSLEF---GEDS----LARWWLEKDF----LK-EIPEKILTKAMSLEDVKKLIMTDVLP
2C95 Chain:A ((7-192))
KKTNIIFVVGGPGSGKGTQCEKIVQKY--GYTHLSTGDLLRSEVSSGSARGKKLSEIMEKGQLVPLETVLDMLRDAMVAKVNTSKGFLIDGYPREVQQGEEF---ERRIGQPTLLLYVDAGPETMTQRLLKRGETSGRVDDNEETIKKRLETYYKATEPVIAFYEKRGIVRKVNAEGSVDSVFSQVCTHLDA
General information:
TITO was launched using:
RESULT:
Template:
2C95.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -66221 for 1103 contacts (-60.0/contact) +
2D Compatibility (PS) -16878 + (NN) -6825 + (LL) 244
1D Compatibility (HY) -1200 + (ID) 1150
Total energy: -92030.0 ( -83.44 by residue)
QMean score : 0.437
(partial model without unconserved sides chains):
PDB file :
Tito_2C95.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-2C95-query.scw
PDB file :
Tito_Scwrl_2C95.pdb
: