Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MKAVVVNQASTGVEVVEHDLPKVGHGEALVKVEYCGVCHTDLHVAHGDFGQVPGRI-----------LGHEGIGIVEEIGEGVTSLRVGDRVSI-AWFFEGCGHCEYCTTGRETLCRSVKNAGYSVDGGMSEYAVVT-ADYAVKVPEGLDPAQASSITCAGVTTYKAIKEAGAAPGQ-WIAVYGAGGLGNLAVQYAKKVFNAHVVAVDINADKLQLAKEVGADLTVNGKEIKDVAAYIQE--KTGGCHGVVVTAVSKVAFNQAIDSVRAGGTVVAVGLPSEYMELSIVKTVLDGIRVVGSLVGTRKDLEEAFAFGAEGLVVPVVEK-VPVDTAPQVFDEMERGLIQGRKVLDFTK |
1R37 Chain:A ((1-345)) | MRAVRLVEIGKPLSLQEIGVPKPKGPQVLIKVEAAGVCHSDVHMRQGRFGNL--RIVEDLGVKLPVTLGHEIAGKIEEVGDEVVGYSKGDLVAVNPW--QGEGNCYYCRIGEEHLCDSPRWLGINFDGAYAEYVIVPHYKYMYKL-RRLNAVEAAPLTCSGITTYRAVRKASLDPTKTLLVVGAGGGLGTMAVQIAKAVSGATIIGVDVREEAVEAAKRAGADYVINA-SMQDPLAEIRRITESKGVDAVIDLNNSEKTLSVYPKALAKQGKYVMVGLFGADLHYHAPLITLSEIQFVGSLVGNQSDFLGIMRLAEAGKVKPMITKTMKLEEANEAIDNLENFKAIGRQVLIP-- |
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General information:
TITO was launched using:
| RESULT:
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Template: 1R37.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -209030 for 2972 contacts (-70.3/contact) +
2D Compatibility (PS) -35534 + (NN) -6069 + (LL) -68
1D Compatibility (HY) -24400 + (ID) 5700
Total energy: -280801.0 ( -94.48 by residue)
QMean score : 0.519
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