Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MIMKKKILAYALSALTCGLFTSCSDWLDINHDPNTAEKVDPGYLFNYVAVNWAGTRTGGDFYIPLSMSSQCQVDGGLDYGGWDESVYTISPYSTGNTWKHYYSVGGNNLMLAIKNAEEADPVNHNAIAQCKILLAEHMY-EATMLWGDIPFTESWNGTIKYPKFDSQESVLNGVLSLLDEALQIMDLNDANAIDEYDIYYKGDMNKWMTLAKSLKFRTLMVM--VDKDPSKATAIGTL-LQAGGMVSSASDNLVFPYSAEPGNQNPKY----ELIELVGGTQILFFASNYMLKPMQERNDPRIPCYFEPG--ADGVYRGLGNREPAVTDDKDNMLSSVVSSYLFR----KDAPELIYSCQEQLLLEAEAYARGLGVAQNLSKANELYKKGIREACAFYGVAEADIDTYVTGLPELTALT-------------------------------QEKALYEIHMQQWIDLMDRPFEEFVQWRRSGTAGNEVPTLQVPEDATSKELI----------RRWEYSPEEMTANINAPKESPKIWEKLWFDL |
3EHN Chain:A ((110-501)) | -------------------------------------------------------------------------------------------------------------------AKDSDSPSEQAILEIANIVRNIAWLRATDVFGPIAYNSAGDGSIA-PKFDSQEVVYRSMLADLSKSVELLNTISYSVMAQYDLIYNGNVQNWVKLANSLMLRIVVRVHFIDETLAKEYITKALDPKNGGVIEDISSEAKIKSSDKMPLLNSMLASVNEYNETRMGATIWGYLDGY--------KDPRLSAYFTEGTYGSGSWAQTGYFPVAPTNSKSKSETSYSAKFASRPKVDSNSPLYWFRASETYFLKAEAALYNLIGGD----PKTFYEQGINISFQEQGV--SGVATYLSGTGKPTGLTGSNYKYGTYNHDLSIGNTSPKWDDYTGNLSKQEEQLQKIITQKYLALYPNAVEAWTEYRRTG-----FPYLMKPMDEAAPGRIGASIEDCRVPERFRFAPTAYNSNPN---------------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 3EHN.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -63786 for 2510 contacts (-25.4/contact) +
2D Compatibility (PS) -35930 + (NN) -16520 + (LL) 7796
1D Compatibility (HY) -16800 + (ID) 4650
Total energy: -129890.0 ( -51.75 by residue)
QMean score : 0.252
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