Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MSNANFSILVDFAAGGLVLASVLIVWRRDLRAIVRLLAWQGAALAAIPLLRGIRDNDRALIAVGIAVLALRALVLPWLLARAVGAEAAAQREATPLVNTASSLLITAGLTLTAFAITQPVVNLEPGVTINAVPAAFAVVLIALFVMTTRLHAVSQAAGFLMLDNGIAATAFLLTAGVPLIVELGASLDVLFAVIVIGVLTGRLRRIFGDADLDKLRELRD |
3WGU Chain:G ((27-48)) | -------------------------------------------------------------------------------------------------------------------------------RNGGLIFAALAFIVGLIIILSK----------------------------------------------------------------------- |
|
General information:
TITO was launched using:
| RESULT:
|
Template: 3WGU.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
|
3D Compatibility (PKB) -6540 for 78 contacts (-83.8/contact) +
2D Compatibility (PS) -2413 + (NN) -1628 + (LL) 18420
1D Compatibility (HY) -2000 + (ID) 100
Total energy: 5739.0 ( 73.58 by residue)
QMean score : -0.106
|
|
|