Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MHNDLKEVLLTEEDIQNICKELGAQLTKDYQGKPLVCVGILKGSAMFMSDLIKRIDTHLSIDFMDVSSYHGGTESTGEVQIIKDLGSSIENKDVLIIEDILETGTTLKSITELLQSRKVNSLEIVTLLDKPNRRKADIEAKYVGKKIPDEFVVGYGLDYRELYRNLPYIGTLKPEVYSN
2GEB Chain:A ((9-184))
-MEDIEEILITEEQLKAKVKELGEMITRDYEGKDLVLIGVLKGAIMFMSGLSRAIDLPLSIDFLAVSSYGSSTKSSGIVKIIKDHDIDIEGKDVLIVEDIIDSGLTLAYLRETLLGRKPRSLKICTILDKPERREADVKVDYCGFKIPDKFVVGYGIDYAEKYRNLPFIGVLKPELY--
General information:
TITO was launched using:
RESULT:
Template:
2GEB.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -127615 for 1366 contacts (-93.4/contact) +
2D Compatibility (PS) -18928 + (NN) -3634 + (LL) 100
1D Compatibility (HY) -22000 + (ID) 5050
Total energy: -177127.0 ( -129.67 by residue)
QMean score : 0.544
(partial model without unconserved sides chains):
PDB file :
Tito_2GEB.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-2GEB-query.scw
PDB file :
Tito_Scwrl_2GEB.pdb
: