Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MTLSFSDTYRLNNGIEMPRHGFGVYKLTDEARMRTALETAVDVGYRLFDTASFYHNEKELGDFFASSGLK-RDEFFVTTKMWNTEQGYDETLRAFEKSQKKLQLDQIDLYLVHWP--KQDTFFDTWRAVEKLYDEGLVRAIGVSNFEAHHLDRLRTSANVLPVVDQLETHPHFPNHLLHRYLEELHIVHQAWSPLGRGGVLQEQILIDLAEKHGKSPAQIVLRWHLQNNISIIPKSETPSRIRENAAIYDFELSEADMRQVERLNTGERVSHAPDVMYVRSEI |
3WBY Chain:B ((19-267)) | ----------FHDGHTMPQIGLGVWE-TPPDETAEVVKEAVKLGYRSVATARLYKNEEGVG-----KGLEDHPEIFLTTKLWNDEQGYDSTLRAYEESARLLRRPVLDLYLIHWPMPAQGQYVETWKALVELKKSGRVKSIGVSNFESEHLERIMDATGVVPVVNQIELHPDFQQRALREFHEKHNIRTESWRPLGKGRVLSDERIGKIAEKHSRTPAQVVIRWHLQNGLIVIPKSVNPKRLAENLDVFGFVLDADDMQAIEQMD------------------ |
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General information:
TITO was launched using:
| RESULT:
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Template: 3WBY.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -101935 for 2066 contacts (-49.3/contact) +
2D Compatibility (PS) -26478 + (NN) -10699 + (LL) 2444
1D Compatibility (HY) -23600 + (ID) 5450
Total energy: -165718.0 ( -80.21 by residue)
QMean score : 0.573
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