Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MAILNILEFPDPRLRTIAKPVEVVDDAVRQLIDDMFETMYEAPGIGLAATQVNVHKRIVVMDLSEDKSEPRVFINPEFEPLTEDMDQYQEGCLSVPGFYENVDRPQKVRIKALDRDGNPFEEVAEGLLAVCIQHECDHLNGKLFVDYLSTLKRDRIRKKLEKQHRQQA
2AI8 Chain:A ((1-166))
-SVLQVLHIPDERLRKVAKPVEEVNAEIQRIVDDMFETMYAEEGIGLAATQVDIHQRIIVIDVSENRDERLVLINPELLEKSGETG-IEEGCLSIPEQRALVPRAEKVKIRALDRDGKPFELEADGLLAICIQHEMDHLVGKLFMDYLSPLKQQRIRQKVEKLDRLKA
General information:
TITO was launched using:
RESULT:
Template:
2AI8.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -64011 for 1286 contacts (-49.8/contact) +
2D Compatibility (PS) -17853 + (NN) -6605 + (LL) 328
1D Compatibility (HY) -18800 + (ID) 4700
Total energy: -111641.0 ( -86.81 by residue)
QMean score : 0.714
(partial model without unconserved sides chains):
PDB file :
Tito_2AI8.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-2AI8-query.scw
PDB file :
Tito_Scwrl_2AI8.pdb
: