Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MQEVHDYGINFWSNNEFKIEKGLVKVCHGKNPSLLEIVQSVHDKGYRGPLLVRFPHLVQKQIKSLFDAFSLAIKEYQYSGAFKAVFPLKVNQMPSFVLPLVQGAKGLNYGLEAGSKSELIIAMSYTN-PTAPITVNGFKDKEMIELGFIAKSMQHEITLTIEGLNELKTIIAVAKQNDFVACPKIGIRIRLHSAGTGVWAKSGGINSKFGLSSTEVLEAMRLLEENDLLEHFHMIHFHIGSQISDISPLKKALREAGNLYAELRKMGAKNLNSVNIGGGLAVEYTQHKHHQDKNYTLEEFSADVVFLLREIVKNKQEIEPDIFIESGRYISANHAVLVAPVLELFSHEYNEKSLKIKENNNPPLIDEMLDLLANINEKNAIEYLHDSFDHTESLFTLFDLGYIDLIDRSNTEVLAHLIVKKAVQLFYVKDHNDILRIQEQVQERYLLNWSFFQSLPDYWGLRQNFPVMPLNKLDEKPTRSASLWDITCDSDGEIAFDSTKPLFLHDIDIDEEEYFLAFFLVGAYQEVLGMKHNLFTHPTEFSVVFDEKGDYEVEDICEAQTILDVLDDLDYDTKEIERLLKQKIEDNNQLDMEEKKEIMGRLYVMLSENGYLRTIS |
2P3E Chain:A ((22-415)) | ------------------------------GVSLKELA-----QTFGTPLYVYSSNFIKERFEAYRKAFP----------DALICYAVKANFNPHLVKLLGELG----AGADIVSGGELYLAKKAGIPPERIVYAGVGKTEKELTDAVD---SEIL-MFNVESRQELDVLNEIAGKL--GKKARIAIRVNP---------------SKFGVDIREAQKEYEYASKLENL-EIVGIHCHIGSQILDISPYREAVEKVVSLYESLTQKGF-DIKYLDIGGGLGIKYKPEDK----EPAPQDLADLLKDLL---------VKAKIILEPGRSIMGNAGILITQVQFLKDKGSK--------------------------------------------------------------------------------------------HFIIVDAGMNDLIRPSI-YNAYHHIIPVET-KE---VVADIVGPICETGDFLA----LDREIEEVQRG---EYLAVLSAGAYGFAMSSHYNMRPRAAEVLVE---NGS--VKLIRKRENYDYIVEPSLDI-------------------------------------------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 2P3E.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -275125 for 3210 contacts (-85.7/contact) +
2D Compatibility (PS) -39636 + (NN) -8450 + (LL) 15984
1D Compatibility (HY) -16800 + (ID) 4150
Total energy: -328177.0 ( -102.24 by residue)
QMean score : 0.455
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