Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
| Query sequence | MRKLTKMSAMLLASGLILTGCGGNKGLEEKKENKQLTYTTVKDIGDMNPHVYGGS-MSAESMIYEPLVRNTKDG-IKPLLAKKWDVSEDGKTYTFHLRDDVKFHDGTTFDADAVKKNIDAVQQNKKLHSWLKISTLIDNVKVKDKYTVELNLKEAYQPALAELAMPRPYVFVSPKDFKNGTTKDGVKKFDGTGPFKLGEHKKDESADFNKNDQYWGEKSKLNKVQAKVMPAGETAFLSMKKGETNFAFTDDRGTD-SLDKDSLKQLKDTGDYQVKRSQPMNTKMLVVNSGKKDNAVSDKTVRQAIGHMVNRDKIAKEILDGQEKPATQLFAKNVTDINFDMPTRKYDLKKAESLLDEAGWKKGKDSDVRQKDGKNLEMAMYYDKGSSSQKEQAEYLQAEFKKMGIKLNINGETSDKIAERRTSGDYDLMFNQTWGLLYDPQSTIAAFKAKNGYE-SATSGIENKDKIYNSIDDAFKIQNGKERSDAYKNILKQIDDEGIFIPISHGSMTVVAPKDLEKVSFTQSQYELPFNEMQYK |
| 4OES Chain:A ((1-498)) | --------------------------------DPKLNFSWPVNVGPLNPHLYSPNQMFAQNMVYEPLVHYNADGTVGPWLAESWEASQDGRSYTFKLREDVKFSNGEVFDAAAVKANIDTVLQNRPRHNWLELVNQMVSAEVVGPYKVRINLKKPYYPLLQELSLPRPFRFIAPSQFKNGGTADGIVAPIGTGPWKLTETKLGEHDVFTRNDSYWGPKPAYEQITVKVIPDPNTRAIAFEAGEIDLIY----GTEGPISPDTFERFQKMGIYNTELSEPLETRVLALNTNH--GATKDLAVRKAINHAVDKDTMIATVLYGTQKRADTLFADNVPYANIGLKPYAFDPALAARLLDEAGWTAKASGDIREKDGQPLAIELCFIGTDAISKSMAEIVQADLRKVGIDVKLTGEEESSIYARQRDGRFDMIFNQTWGAPYDPHAFVSSMRVPSHADYQAQLGLPDKAKIDAEIGQVLVSTDETARQALYKDILTRLHEEAVYLPLTSVTAMAVAKPEVGKITFGAMSSEIPFEKLTPK |
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General information:
TITO was launched using:
| RESULT:
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Template: 4OES.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -66366 for 4185 contacts (-15.9/contact) +
2D Compatibility (PS) -53635 + (NN) -18655 + (LL) 2056
1D Compatibility (HY) -38800 + (ID) 9050
Total energy: -184450.0 ( -44.07 by residue)
QMean score : 0.510
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