Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
| Query sequence | MNPEQFQMALAEKGIELSDDQMKQFHDYFEMLVEWNEKMNLTAITDEKEVYLKHFYDSISAAFYVDFTKFDTICDVGAGAGFPSLPIKICFPHLKVSIVDSLKKRMTFLDALAEKLGLT-DVHFYHDRAETFGQNKAHREKYDLVTARAV----ARMSVLSELCMPLVKKGGSFLVMKAAQA----------------------EQELQTAEKAIKLFGGKVEEHFSFSLPVEESERNIYVITKTKETPNKYPRKPGTPNKLPIE |
| 3BUS Chain:A ((61-217)) | --------------------------------------------------------------------SGDRVLDVGCGIGKPAVRLATA-RDVRVTGISISRPQVNQANARATAAGLANRVTFSYADAMDLPF---EDASFDAVWALESLHHMPDRGRALREMARVLRPGGTVAIADFVLLAPVEGAKKEAVDAFRAGGGVLSLGGIDEYESDVRQAELVVTSTVDIS------------------------------------ |
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General information:
TITO was launched using:
| RESULT:
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Template: 3BUS.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -65169 for 923 contacts (-70.6/contact) +
2D Compatibility (PS) -13750 + (NN) -1986 + (LL) 7688
1D Compatibility (HY) -1200 + (ID) 1150
Total energy: -75567.0 ( -81.87 by residue)
QMean score : 0.392
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