Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MLGNTIHVPCQPCRHGHGAPSRGLRGRPADRWPVARATPTLHVCPQNQGVGLDFVRKPEYGRLRWPAYPAGTNNDRLISMRDGGIVALPQLTDEQRAAA---LEKAAAARRARAELKDRLKRGGTNLTQVLKDAESDEVLGKMKVSALLEALPKVGKVKAQEIMTELEIAPTRRLRGLGDRQRKALLEKFGSA |
3NEH Chain:A ((111-217)) | --------------------------------------------------------------------PIGRDLDKLTQLLDGGVLSVGLTWNNANLAADGIMEERGAG----------LTRFGKDIIHLLNERKVFTDVSHLSVKAFWETLEQAEFVIASHSNAK---AICSHPRNLDDEQIKAMIE----- |
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General information:
TITO was launched using:
| RESULT:
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Template: 3NEH.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -1655 for 732 contacts (-2.3/contact) +
2D Compatibility (PS) -10558 + (NN) 453 + (LL) 4132
1D Compatibility (HY) -5200 + (ID) 1450
Total energy: -14278.0 ( -19.51 by residue)
QMean score : 0.180
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