Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MTNEKGIVFNIQHFSIHDGPGIRTTVFLKGCPLRCPWCANPESQKMVPETMRDAITNESVIVGEEKSVDDIIEEVLKDIDFYEESGGGITLSGGEIFAQF-EFAKAILKRAKSLGIHTAIETTAY---------TRHEQFVDLIQ-YVDFIYTDLKHYNSLKHQEKTMVKNASIIKNIHYAFANGKTIVLRIPVIPNFNDSLEDAEEFACLFDRLDIRQVQLLPFHQFGQNKYRLLNRQYEMEEIAALHPEDLLDYQAIFSKYNIHCYF |
2A5H Chain:A ((110-299)) | ---------------THRYPDRVLLLITDMCSMYCRHCTRRRFAGQS---------------DDSMPMERIDKAIDYIRNTPQ--VRDVLLSGGDALLVSDETLEYIIAKLREIP-HVEIVRIGSRTPVVLPQRITPELVNMLKKYHPVWLNTHFNHPNEI---------TEESTRACQLLADAGVPLGNQSVLLRGVNDCVHVMKELVNKLVKIRVRPYYIYQCDLSLGLEHFRTPVSKGIEIIEGLRGHTSGYCVPTFVVDAPGGGG |
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General information:
TITO was launched using:
| RESULT:
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Template: 2A5H.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -56539 for 1301 contacts (-43.5/contact) +
2D Compatibility (PS) -19690 + (NN) -14642 + (LL) 3520
1D Compatibility (HY) -2800 + (ID) 1200
Total energy: -91351.0 ( -70.22 by residue)
QMean score : 0.466
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