Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MDHSHHMGMSYMDSNSTMQPSHHHPTTSASHSHGGGDSSMMMMPMTFYFGFKNVELLFSGLVINTAGEMAGAFVAVFLLAMFYEGLKIARESLLRKSQVSIRYNSMPVPGPNGTILMETHKTVGQQMLSFPHLLQTVLHIIQVVISYFLMLIFMTYNGYLCIAVAAGAGTGYFLFSWKKAVVVDITEHCH |
2K21 Chain:A ((42-65)) | ------------------------------------------------------------------------------------------------------------------------------------------------LEALYVLMVLGFFGFFTLGIMLSYIRSKKLEHSNDPFNVYIESDAW |
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General information:
TITO was launched using:
| RESULT:
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Template: 2K21.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -10532 for 92 contacts (-114.5/contact) +
2D Compatibility (PS) -2293 + (NN) 1426 + (LL) 9612
1D Compatibility (HY) -4400 + (ID) 100
Total energy: -6287.0 ( -68.34 by residue)
QMean score : -0.364
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