Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MNAADRVMQSYGRCCA-S----TGFFDDFYRHFLASSPQIRAKFATT------------DMTAQKHLLRAGIMNLVMYARGMS--DSKLRALGASHSRAAL--DIRPELYDLWLDALLMAVAEHDRDCDAETRDAWRDVMGRGIAVIKSYY
1ASH Chain:A ((3-147))
-KTRELCMKSLEHAKVDTSNEARQDGIDLYKHMFENYPPLRKYFKSREEYTAEDVQNDPFFAKQGQKILLACHVLCATYDDRETFNAYTRELLDRHAR--DHVHMPPEVWTDFWKLFEEYLGKKTT-LDEPTKQAWHEIGREFAKEINK--
General information:
TITO was launched using:
RESULT:
Template:
1ASH.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -72510 for 828 contacts (-87.6/contact) +
2D Compatibility (PS) -13551 + (NN) -9024 + (LL) 604
1D Compatibility (HY) -3600 + (ID) 1050
Total energy: -99131.0 ( -119.72 by residue)
QMean score : 0.527
(partial model without unconserved sides chains):
PDB file :
Tito_1ASH.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-1ASH-query.scw
PDB file :
Tito_Scwrl_1ASH.pdb
: