Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MLTVSDVSLRFSDRKLFDEVNINFTAGNTYGLIGANGAGKSTFLKILAGDIEPTTG--HIALGPDERLSVLRQNHFDYEDERVIDVVIMGNETLYSIMKEKDAIYMKEDFSDE----DGVRAAELEGEFAELGGWEAESEASQLLQNLNISEELHYQNM-----SELANGDKVKVLLAKALFGKPDVLLLDEPTNGLDIQSITWLEDFLIDF--ENTVIVVSHDRHFLNKVCTHMADLDFGKIKLFVGNYDFW-KESSELAARLQADRNAKAEEKIKQLQEFVARFSANASKSKQATSRKKMLDKIELEEIVPSSRKYPFVNFKAEREMGNDLLTVENLSVTIDGEKILDNISFILRPGDKTALIGQNDIQTTALIRALMGDIEY-EGTIKWGVTTSRSYLPKDNSRDFASGESILEWLRQFASKEEDDNT--FL-----RGFLGRMLFSGDEVNKSVNVLSGGEKVRVMLSKLMLLKSNVLVLDDPTNHLDLESISSLNDGLKDF---KESIIF-ASHDHEFIQTLANHIIVLSKNGVIDRIDETYDEFLENTEVQAKVAQLWK |
3OZX Chain:A ((29-459)) | ------------------------------GVLGKNGVGKTTVLKILAGEIIPNFGDPNSKVGKDEVLKRFR-----------------GKE-IYN--------YFKELYSNELKIVHKIQYVEYASKFLKGTVNEILTKIDERGKKDEVKELLNMTNLWNKDANILSGGGLQRLLVAASLLREADVYIFDQPSSYLDVRERMNMAKAIRELLKNKYVIVVDHDLIVLD----YLTDL----IHIIYGESSVYGRVSKSYAARV-------------GINNFLKGYLPAENMKIRPDEIKFMLK-------LKTKMKWT----KIIKKLGDFQLVVDN------GEA---------KEGEIIGILGPNGIGKTTFARILVGEITADEGS----VTPEKQILSYKPQRIFPNYDGTVQQYLENASKDALSTSSWFFEEVTKRLNLHRLLES------NVNDLSGGELQKLYIAATLAKEADLYVLDQPSSYLDVEERYIVAKAIKRVTRERKAVTFIIDHDLSIHDYIADRIIVFKGEPEKAGLATSPVTLKTGMNEFLRELEVTF |
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General information:
TITO was launched using:
| RESULT:
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Template: 3OZX.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -69905 for 3088 contacts (-22.6/contact) +
2D Compatibility (PS) -41738 + (NN) -11431 + (LL) 8960
1D Compatibility (HY) -30400 + (ID) 6000
Total energy: -150514.0 ( -48.74 by residue)
QMean score : 0.322
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