Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | --MKMTDPLYGTFEIEPVLAELIQSPLVSRLAHVHQGGSSYLVNPLWDLSRLDHSIGVMLFIRKFGGSLEE------QIAGLLHDVSHTAFSHVVDYALDFEEEDYHEQIFEDFVKTSTIPAIL---------EKYGYSFEGIFNDISKWKILEQEAPELCADRIDYTLQDLYRHG-KISLAEVKEFLQALVMVDGRLYL---ANIALAEWFVAQYYSEVIDYFYDPLNVYSYEILAEAMRIAFQQETITTAD--LRLTDAELLAKLNANSDAREKIQLLA-------------SPHLEENEVDFTYHHKKKMRLINPSV----------LVDGRLIPADELSEKVREMNDWASERSKHGIYIKATKKSKQ----- |
2HEK Chain:A ((1-369)) | MIKEFSDPLYGFVRVGEAGLRLIDSFPFQRLRYVKQLGLAYLVFPSAQHTRFEHSLGVYHITERICESLKVKEKELVKLAGLLHDLGHPPFSHTTEVLLPRERS--HEDFTERVIKETEIYEILKQDYSHEDIERLVRITLGKPEDEEEKLLSEIITGEFGSDRMDYLRRDAYFCGVSYGFFDYDRLISTLRVYENKVVVDESGLRALENFLISRYFMYVQVYFH-KVVRILSIHLVEFLKKLISQEDFTDINNFLRLNDAFVISELFKRKAFREDFERIFQRKHFKTLLSTENYEKFSETKERLLEKFPQEKVRFDEVEKEVYGGNIYVLSSEGLKKAHELSPLIASLK----PIKLYRIYVDRQLWEKARSELK |
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General information:
TITO was launched using:
| RESULT:
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Template: 2HEK.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -150516 for 2409 contacts (-62.5/contact) +
2D Compatibility (PS) -33338 + (NN) -7897 + (LL) 136
1D Compatibility (HY) -17600 + (ID) 4250
Total energy: -213465.0 ( -88.61 by residue)
QMean score : 0.445
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