Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MTAALPDLSFHPAWHAQLELAYARAGDATRPVTRRHAGPLRVQKHLYAEGPEVCQHILVHPPGGIAGGDSLAFDVRLGERAWAQLTSPGAAKWYRAACPARQTLEIHLEPGATLEWLPQESIVFAGAQAELETRIQLRGDARLFYWDMVALGRPASGERFASGHFVAALDIRRDDRLLWHERQRIDGGDRLLDSPIGLAGHPVLATLVASGEIDTDLLQRCRALPCAGRGNLSQLPGGLLVARCLADEALHARAWLIELWRLLRPALLGREAVPPRIWST |
2A9D Chain:A ((300-330)) | ------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------VARLMGDKAPPGRAWAWALWELTVPVEAGTE--------- |
|
General information:
TITO was launched using:
| RESULT:
|
Template: 2A9D.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
|
3D Compatibility (PKB) -3221 for 105 contacts (-30.7/contact) +
2D Compatibility (PS) -2921 + (NN) 4215 + (LL) 15980
1D Compatibility (HY) -1200 + (ID) 700
Total energy: 12153.0 ( 115.74 by residue)
QMean score : -0.220
|
|
|