Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MFANKILTEKDTDQIRFSILASGS--SGNATLVETGDQKILIDCGLSGKKMEGLFAQV----GRDMNDLDAILITHEHSDHIKGLGVLARK-YKLPIYANAKTWKAMDNMIGEV-S------------S-------DQKFQFDMETVKNF-GSMQVESFGVSHDAIEPMF-YIFHKGNKKFVMITDTGYVSDRMK----GHIAGADAYLFESNHDVEMLRMGRYPWNVKRRILGDEGHVSNEDAAIAMSEVITDQTKRIYLGHLSKDNNMKELARMSVTQTLMAEGIDVGGKLEIFDTDPDNATSIFTI |
2XR1 Chain:A ((181-415)) | -----------DQWVRVTALGGCKEVGRSCFLLSTPESRILIDCGVNVGSDENMTPYLYVPEVFPLNQIDAVIVTHAHLDHQGLVPLLFKYGYEGPVYCTPPTRDLMVLLQLDYIDVAAKEGKKIPYESGMVAKTLKHTIPLDYEEVTDIAPDIKLTFHNAGHILGSAISHFHIGDGLHNVVFTGDYKYEKTRLFDPAVNKFPRVETVISEATYGN--------------------------------------------------------------------------------------------- |
|
General information:
TITO was launched using:
| RESULT:
|
Template: 2XR1.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
|
3D Compatibility (PKB) -82638 for 1340 contacts (-61.7/contact) +
2D Compatibility (PS) -18422 + (NN) -2350 + (LL) 7240
1D Compatibility (HY) -11200 + (ID) 1800
Total energy: -109170.0 ( -81.47 by residue)
QMean score : 0.403
|
|
|