Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MALPITNGTLFMPFVLTFIGIPGFESVQCWIGIPFCATYVIALIGNSLLLIIIKSEPSLH--EPMYIFLATLGATDISLSTSIVPKMLDIFWFHLPEIYFDACLFQMWLIHTFQGIESGV--LLAMALDRCVAICYPLRRAIVFTRQL-------VTYIVVGVTLRPAILVIPCLLLIKCHLKLYRTKLIYHTYCERVALVKLATEDVYINKVYGILGAFIVGGLDFIFIT---------LSYIQIFITVFHLPLKEARLKVFNTCIPHIYVFFQFYLLAFFFIFY----SQIWILYPIICTYHLVQSLPTGPTIPQPLYL----WVKDQTH |
4RKS Chain:A ((21-337)) | --TYRSIGSTAYP-TIGVVLLGGIAN-----PVTRTPLHTSAGIAYSDSCGSIRSETRIYADEATHIYFNGTESTD---DNRSVRRVLDRYSSVFEEAFGTK---TVSYSSQNFGILSGSSDAGAASIGAAILGLKPDLDPHDVENDLRAVSESAGRSLFGGLTITWSDGFHAYTEKILDPEAFSGYSIVAFAFDYQRNPSDVIHQNIVRSDLYPARKKHADEHAHMIKEYAKTNDIKGIFDLAQEDTEEYHSILRGVGVNVIRENMQKLISYLKLIRKDYWNAYIVTGGSNVYVAVESENADRLFSIENTFGSKKKMLRIVGGAWHRRPE- |
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General information:
TITO was launched using:
| RESULT:
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Template: 4RKS.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -360141 for 2300 contacts (-156.6/contact) +
2D Compatibility (PS) -29931 + (NN) 4558 + (LL) 1972
1D Compatibility (HY) 4400 + (ID) 1900
Total energy: -381042.0 ( -165.67 by residue)
QMean score : 0.134
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