Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MDNEKGLLIVLSGPSGVGKGTVRKRIFEDPSTSYKYSISMTTRQMREGEVDGVDYFFKTRDAFEALIKDDQFIEYAEYVGNYY--GTPVQYVKDTMDEGHDVFLEIEVEGAKQVRKKFPDALFIFLAPPSLDHLRERLVGRGTESNEKIQSRINEARKEVEMMNLYDYVVVNDEVELAKNRIQCIVEAEHLKRERVEAKYRKMILEAKK
1ZNY Chain:A ((20-191))
-----GRVVVLSGPSAVGKSTV-VRCLRERIPNLHFSVSATTRAPRPGEVDGVDYHFIDPTRFQQLIDQGELLEWAEIHGGLHRSGTLAQPVRAAAATGVPVLIEVDLAGARAIKKTMPEAVTVFLAPPSWQDLQARLIGRGTETADVIQRRLDTARIELAAQGDFDKVVVNRRLESA-------------------------------
General information:
TITO was launched using:
RESULT:
Template:
1ZNY.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -66403 for 1142 contacts (-58.1/contact) +
2D Compatibility (PS) -18346 + (NN) -4916 + (LL) 3844
1D Compatibility (HY) -12800 + (ID) 3700
Total energy: -102321.0 ( -89.60 by residue)
QMean score : 0.616
(partial model without unconserved sides chains):
PDB file :
Tito_1ZNY.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-1ZNY-query.scw
PDB file :
Tito_Scwrl_1ZNY.pdb
: