Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | -----MSNANNADNKQFFSKILNSIGAGVVIALVPNALL-GEVLKIFKSGNEILELTYQLVILIQLFMAFIIGVLAAHQFKFNGAGAAIVGTSAMIGSGAVVYSNNSFMLKGIGDIINTSLVVIIACLIYMVLQ-NKLGSFELIILPVLVPIVSGGIGLITLPYIRKITQAIGNVIHSFTDLNPLLMSILISVAFSLLMVTPISLV------AIATAISL-NGLGSGAANLGIVAACVTFLFGSL---------------RVNSIGVNAVLLIGAAKMMIP------VYLKNLIISIPLTINGIITGIIAYVLQVKGTPLSAGFGYT--GLVGPINAFNRMSGDPTMNIILLALGYFVIPFVSAFIVHELCKKFIPIYSNDIYKFEVPKQ |
4BWZ Chain:A ((3-386)) | GAEHLLEIFYLLLAAQVCAFIFKRLNQPVVIGEVLAGVLVGPALLGLVHEGEILEFLAELGAVFLLFMVGLETRLKDILAVGKEAFLVAVLGVALPFLGGYLYGLEIGFETLPALFLGTALVATSVGITARVLQELGVLSRPYSRIILGAAVIDDVLGLIVLACVNGVAETGQVEVGAITRLIVLSVVFVGLAVFLSTLIARLPLERLPVGSPLGFALALGVGMAALAASIGLAPIVGAFLGGMLLSEVREKYRLEEPIFAIESFLAPIFFAMVGVRLELSALASPVVLVAGTVVTVIAILGKVLGGFLGALTQGVRSALTVGCGMAPRGEVGLIVAALGLKAGAV-NEEEYAIVLFMVVFTTLFAPFAL-KPLIAWTERERAAKE---- |
|
General information:
TITO was launched using:
| RESULT:
|
Template: 4BWZ.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
|
3D Compatibility (PKB) -358683 for 3127 contacts (-114.7/contact) +
2D Compatibility (PS) -34518 + (NN) 7048 + (LL) 500
1D Compatibility (HY) -20400 + (ID) 3500
Total energy: -409553.0 ( -130.97 by residue)
QMean score : 0.228
|
|
|