Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MTAISCSPRPRYASRMPVLSKTVEVTADAASIMAIVADIERYPEWNEGVKGAWVLARYDDGRPSQVRLDTAVQGIE-GTYIHAVY-YPG-ENQIQTVMQQG-ELFAKQEQLFSVVATG-AASLLTVDMDV-----QVTMPVPEPMVKMLLNNVLEHLAENLKQRAEQLAAS
3JRS Chain:A ((51-206))
-------------NGRCSSLLAQRIHAPPETVWSVVRRFDRPQIYKHFIKSCNVSEDFEMRVGCTRDVNVIS-GLPANTSRERLDLLDDDRRVTGFSITGGEHRLRNYKSVTTVHRFEK----RIWTVVLESYVVDVPEGNSEEDTRLFADTVIRLNLQKLASITEAMN--
General information:
TITO was launched using:
RESULT:
Template:
3JRS.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -37855 for 963 contacts (-39.3/contact) +
2D Compatibility (PS) -15597 + (NN) -7298 + (LL) 1436
1D Compatibility (HY) -1600 + (ID) 700
Total energy: -61614.0 ( -63.98 by residue)
QMean score : 0.327
(partial model without unconserved sides chains):
PDB file :
Tito_3JRS.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-3JRS-query.scw
PDB file :
Tito_Scwrl_3JRS.pdb
: