Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MNIDMAALHAIEVDRGISVNELLETIKSALLTAYRHTQGHQTDARIEIDRKTGVVRVIARETDEAGNLISEWDDTPEGFGRIAATTARQVMLQRFRDAENERTYGEFSTREGEIVAGVIQRDSRANARGLVVVRIGTETKASEGVIPAAEQVPGESYEHGNRLRCYVVGVTRGAREPLITLSRTHPNLVRKLFSLEVPEIADGSVEIVAVAREAGHRSKIAVRSNVAGLNAKGACIGPMGQRVRNVMSELSGEKIDIIDYDDDPARFVANALSPAKVVSVSVI-DQTARAARVVVPDFQLSLAIGKEGQNARLA----ARLTGWRIDIRGDAPPPPPGQPEPGVSRGMAHDR |
2CXC Chain:A ((26-139)) | -------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------AYRCIVDEENNRLIFLVSEG-----EAGRAIGRGGRLIKLLREAL-GKNIEVVEYSSDLERIVKNLFPGVKIESINVRERNGVKQVVIKVSEDDKGAAIGKGGKNVKRARLVLSKLFGVE--------------------------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 2CXC.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -37003 for 694 contacts (-53.3/contact) +
2D Compatibility (PS) -11817 + (NN) -3609 + (LL) 14804
1D Compatibility (HY) -4800 + (ID) 1400
Total energy: -43825.0 ( -63.15 by residue)
QMean score : 0.363
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