Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MKLDLWKWEMLLQGREFRNKTNDNWQKLMDWSDFISTGLSAIYVYVNKADATLNNKIDTVDKAVN---ARVNELISGTEQLSEVVDARSDA--FGARY--------PVLRERLNQEQLNFSKKSTIQFDASTIISMEKQDIGLLTSKKISEAQTVCFLNISSLDEEADIVLEKTGETSFSDNLTSLVFAKIGTNERYQMEPVGA |
4XSH Chain:B ((67-138)) | ------------------------------------------------SDPTMKKKIESLDKALNRKEAKVNDNIK--------VYRGDDAWIFGKEYDNSIIKNGKVDREKFKEIQKKFQGKTTTEF---------------------------------------------------------------------------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 4XSH.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -1067 for 209 contacts (-5.1/contact) +
2D Compatibility (PS) -6162 + (NN) 574 + (LL) 9640
1D Compatibility (HY) -3600 + (ID) 1300
Total energy: -1915.0 ( -9.16 by residue)
QMean score : 0.341
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