Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MILRRRTIVLWQLGIAISLILSILALNLYFHSTPLQTNAALRNLAPSLNHLFGTDGLGRDMFVRTIKGLYFSLQVGLLGALMGVILATVFGVLAGLGNSIIDKIIAWLVDLFIGMPHLIFMILISFVVGKGAQGVIIATAVTHWPSLARLIRNEVYHLKNKEFVQLSKSMGKTPYYIVRHHILPLIASQIFIGFILLFPHVILHEASMTFLGFGLSAEQPSVGIILSEAAKHISLGNWWLVIFPGLYLILVVNAFDTIGESLKKLFYPQTDHF |
1R52 Chain:A ((210-274)) | ---------------------------------------------------------------------------GNKDSIGGVVTCVVRNLPTGLGEPCFDKLEAMLAHAMLSIP-----ASKGFEIGSGFQGVSVPGSKHNDPFYFTKTNNSGGVQGGISNGENIYFSVPFKSVRHDPAVTPRAIPIVEAMTALVLADALLIQKARDF--------------------------------------------------------------- |
|
General information:
TITO was launched using:
| RESULT:
|
Template: 1R52.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
|
3D Compatibility (PKB) -30481 for 263 contacts (-115.9/contact) +
2D Compatibility (PS) -7017 + (NN) 799 + (LL) 13160
1D Compatibility (HY) -800 + (ID) 950
Total energy: -25289.0 ( -96.16 by residue)
QMean score : -0.085
|
|
|