Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MTVWKTLEKTNHSQSEILSQLIEESDAIVVGIGAGMSAADGFTYIGPRFEEAFPDFIAKYQLLDMLQASLYDFEDWEEYWAFQSRFVALNYLDQPVGQAYLDLKDILA-KKEYHIITTNADNAFAVADYNLEKVFHIQGEYGLWQCSQHCHQQTYRNDQAIRQMIAQQKDMKIPSNLIPKCPKCDQPFEINKRNEEKGMVEDADFHAQRQRYENFLSQHQNDKVLYLEIGVGHTTPQFIKHPFWRFVSLN--ENSLFVTLNHKHYRIPQKIRSRSVQLTQHIAELIAEAKKEIIG |
3U31 Chain:A ((31-281)) | ----------QSITLEELAKIIKKCKHVVALTGSGTSAESNI----PSFRGSSNSIWSKYDPRIYGTIWGF-WKYPEKIWEVIRDISS--DYEIEINNGHVALSTLESLGYLKSVVTQNVDGLHEASGN--TKVISLHGNVFEAVCCT-CN-KIVKLNKIMLQK-----TSHFMHQLPPECP-CGGIFKPNIIL-FGEVVSSDLLKE----AEEEIAKC-D---LLLVIGTSSTVST-----ATNLCHFACKKKKKIVEINISKTYITNKM--SDYHVCAKFSE-LTKVANILKG |
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General information:
TITO was launched using:
| RESULT:
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Template: 3U31.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -110360 for 2057 contacts (-53.7/contact) +
2D Compatibility (PS) -25636 + (NN) -5914 + (LL) 3688
1D Compatibility (HY) -10400 + (ID) 2200
Total energy: -150822.0 ( -73.32 by residue)
QMean score : 0.364
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