Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MLHQLTLAEIARALADKQFSAEELTRTLLGRIRQLD---PQLNSFISITDDLAIAQAKAADERRANGENGALLGAPIAHKDLFCTQGVRTSCGSKMLDNFVSPYDATVVEKLTAAGAVTLGKLNMDEFAMGSSNQS-----SHYGAVKNPWSLDRVPGGSSGGSAAAVAARLLPAATGTDTGGSIRQPAALTNLTGIKPTYGRVSRWGMIAYASSLDQGGPLARTAEDCALMLGVMAGFDPKDSTSVEQP---VDDYLAALQ-KPLSGLRIGLPR----EYFGAGLDSRIADAVLAVVEELKTLGATVKDISLPNMQHAIPAYYVIAPAEASSNLSR-FDGVRYGYRCDAPQNLEDLYKRSRAEG------FGSEVKNRIMVGTYALSAGYYDAYYLQAQKIRRLIKN----DFVSAFAEVDVILGPTTPNPAWKIGEKNDDPVSQYLEDIYTITANLAGLPGLSMPAGFVDGLPVGVQLLAPYFQEGRLLNVAHQYQQVSDWHTRTPAGF |
1M21 Chain:B ((13-492)) | ------VADLQARMTAGELDSTTLTQAYLQRIAALDRTGPRLRAVIELNPDALKEAAERDRERRDGRLRGPLHGIPLLLKDNINAAPMATSAGSLALQGF-RPDDAYLVRRLRDAGAVVLGKTNLSEWANFRGNDSISGWSARGGQTRNPYRISHSPCGSSSGSAVAVAANLASVAIGTETDGSIVCPAAINGVVGLKPTVGLVSRDGIIPISFSQDTAGPMARSVADAAAVLTAIAGRDDADPATATMPGRAVYDYTARLDPQGLRGKRIGLLQTPLLKYRG------MPPLIEQAATELRRAGAVVVPVELPNQGAWAEAERTLLLYEFKAGLERYFNTHRAPLR-----SLADLIAFNQAHSKQELGLFGQE----LLVEADA-TAGLADPAYIRARSDARRLAGPEGIDAALAAHQLDALVAPTT-GVAWPIRSEGDD----FPGESYSAAA-VAGYPSLTVPMGQIDGLPVGLLFMGTAWSEPKLIEMAYAYEQRT--RARRPPHF |
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General information:
TITO was launched using:
| RESULT:
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Template: 1M21.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -164246 for 4354 contacts (-37.7/contact) +
2D Compatibility (PS) -48681 + (NN) -17330 + (LL) 1672
1D Compatibility (HY) -17600 + (ID) 8500
Total energy: -254685.0 ( -58.49 by residue)
QMean score : 0.474
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