Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MSAIERITKAAHLIDMNDIIREGNPTLRTVAEEVTFPLSDQEIILGEKMMQFLKHSQDPVMAEKMGLRGGVGLAAPQLDISKRIIAVLVPNIVEEGETPQEAYDLEAIMYNPKIVSHSVQDAALGEGEGCLSVDRNVPGYVVRHARVTVDYFDKDGEKHRIKLKGYNSIVVQHEIDHINGIMFYDRINEKDPFAVKDGLLILE
2AI7 Chain:A ((2-203))
-SAIERISKAAHLIDMCDIIREGNPSLRTVAEEVTFPLSDQEIILGEKMMQFLKHSQDPVMAEKMGLRGGVGLAAPQLDISKRIIAVLVPNI--------EAYDLEAIMYNPKIVSHSVQDAALGEGEGCLSVDRNVPGYVVRHARVTVDYFDKDGEKHRIKLKGYNSIVVQHEIDHINGIMFYDRINEKDPFAVKDGLLILE
General information:
TITO was launched using:
RESULT:
Template:
2AI7.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -108107 for 1537 contacts (-70.3/contact) +
2D Compatibility (PS) -20330 + (NN) -3642 + (LL) 572
1D Compatibility (HY) -28800 + (ID) 9550
Total energy: -169857.0 ( -110.51 by residue)
QMean score : 0.498
(partial model without unconserved sides chains):
PDB file :
Tito_2AI7.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-2AI7-query.scw
PDB file :
Tito_Scwrl_2AI7.pdb
: