Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | ------------------MSEINEKVEPQ---PIDLGEYKFGFHDDVKPIYSTGKGLNEAVIRELSAAKGEPEWMLDFRLKSLETFNKMPMQTWGADLSD---------IDFDDIIYYQKASDKPARDWDDVPEKIKETFE--RIGIP-EAERAYLAGASAQYESEVVYHNMKEEYDKLGIVFTDTDSALKEYPELFKKYFAKLVPPTDNKLAALNSAVWSGGTFIYVPKGVKVDIPLQTYFRINNENTGQFERTLIIVDEGASVHYVEGCTAPTYSSNSLHAAIVEIFALDGAYMRYTTIQNWSDN---VYNLVTKRATAKKDATVEWIDGNLGAKTTMKYPSVYLDGEGACGTMLSIAFANKGQHQDTGAKMIHNAPHTSSSIV-------------------SKSIAKGGGKVDYRGQVTFNKDSKKSVSHIECDTILMDDISKSDTIPFNEIHNSQVALEHEAKVSKISEEQLYYLMSRGLSEAEATEMIVMGFVEPFTKELPMEYAVELNRLISYEMEGSVG |
3PY7 Chain:A ((3-516)) | IEEGKLVIWINGDKGYNGLAEVGKKFEKDTGIKVTVEHPD-KLEEKFPQVAATGDGPDIIFWAHDRFGGYAQSGLLAEITPAAAFQDKLYPFTWDAVRYNGKLIAYPIAVEALSLIYNKDLLPNPPKTWEEIPALDKELKAKGKSALMFNLQEPYFTWPLIAADGGYAFKYENGKYDIKDVGVDN--AGAKAGLTFLVDLIKNKHMNADTDYSIAEAAFNKGETAMTINGPWAWSNIDTS--------AVNYGVTVLPTFKGQPSKPFVGVLSAGINAASPNKELAKEFLENYLLTDEGLEAVNKDKPLGAVALKSYEEELAKDPRIAATMENAQKGEIMPNIPQMSAFWYAVRTAVINAASGRQTVDAALAAAQTNAAAMDDLDALLADKPFSGLDCLWCREPLTEVDAFRCMVKDF--HVVIREGCRYGACTICLENCLATERRLWQGVPVT---GEEAELLHGKTLDRLCIRCCY--CGGKLTKNEKHRHVLFN--EPFCK-------TRANIIRGRCYDCCRH |
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General information:
TITO was launched using:
| RESULT:
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Template: 3PY7.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -17556 for 3543 contacts (-5.0/contact) +
2D Compatibility (PS) -46535 + (NN) -804 + (LL) 2060
1D Compatibility (HY) -2400 + (ID) 2950
Total energy: -68185.0 ( -19.24 by residue)
QMean score : 0.170
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