Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MPSNALSVGEIAHLINVSHSSVHNWIKTNLLEKLEIDHKIYVKTSSFLDFCRNHLGKNKLNRYANKSLKSAHNHQELILKYLEMLENSSDLENLGSYYEKELSNTTRNLEGIYYTPNRIVEQLFTLPKDFDTTQAIFCDPAVGSGNFVMHALKLGFKVENIYGYDTDAFAVALTKKRIKERYRLDCPNIMQKDFLSLKHAPQFDCIFTNPPWGKKYNQNQ---------KENFKQQFN-LHQSLDSASLFFMASLNCLKENAYLGLLLPESCLNIDAFSKMREMALK-FQMRSLIDFDKPFKNLMTKAVGLALKKTHNKDQKISCFYQNSEFKRSP-SSFFNNPKKIFNIHCSHQKNKILDHLFSLPHITLKNNAHFALGIVTGNNKEK--LHPKQEKNTIPIFRGSDILKDRLKAPSQFINADLKDCQQVAPLSLYQAREKIVYKFI-SSKLVFFYDNKQRLFLNSANMFVLKENFPINAHALKELLNSDLMQFIFESLFK--THKILRKDLECLPLFAQFINNSFDEKFYLKNLGIEKKDPKHFTIRKNHACCLSFGFRG |
2IH2 Chain:A ((21-413)) | ----------------------------------------------------------------------------------------------------------------VETPPEVVDFMVSLAEA--PRGGRVLEPACAHGPFLRAFREAHGTAYRFVGVEIDPKALDLPPW----------AEGILADFLLWEPGEAFDLILGNPPYGIVGEASKYPIHVFKAVKDLYKKAFSTWKGKYNLYGAFLEKAVRLLKPGGVLVFVVPATWLVLEDFALLREFLAREGKT-SVYYLGEVFPQKKVSAVVIRFQKSGKGLSLWDTQESESGFTPILWAEYPHWEGEIIRFET--E---ETRKLEI-SGMPLGDLFHIRFAARSPEFKKHPAVRKEPGPGLVPVLTGRNLKPGWVDYEKNHSGLWMPKERAKELRDFYA-TPHLVVAHTKGTRVVAAWDERAY-PWREEFHLLPKEGVRLDPSSLVQWLNSEAMQKHVRTLYRDFVPHLTLRMLERLPVRREY--GFHT---------------------------------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 2IH2.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -192103 for 3021 contacts (-63.6/contact) +
2D Compatibility (PS) -39101 + (NN) -6170 + (LL) 10856
1D Compatibility (HY) -19200 + (ID) 3250
Total energy: -248968.0 ( -82.41 by residue)
QMean score : 0.331
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