Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MNNSLNSKTTLNVSGKSYGYFSLNAASKFLGIDLAKLPCSLKVLLENLLRNEDEVNVRLDDIKTLA-----GCVKKHVNHEIS-------YKPARVLMQDFTGVPAIVDLASMRSYVKKKGGNPSKINPSVPVDLVIDHSVQVDSYGNTSAFGKNVELEIKRNLERYQFLKWGESSFTNFRVVPPGTGICHQVNLEYLAQVVCNESGVVYPDTL-VGTDSHTTMVNGLSVLGWGVGGIEAESVMIGQPISMVIPEIVGFKLMGRLPEGVTATDLVLTITNILRAKGVVGKFVEFYGDGLDYLSLADRATIANMAPEYGATCGFFPIDQKTLDYLSLTGRPEGLIKLVEVYAKEQGLWRSGEELAFFDILELDLSGVEPVMAGPKRPQDKVSLSQVAESFSTSFSVNESKENDKLQDGSVVIAAITSCTNTSNPSVMIAAGLIARKAIKFGIKSKPWVKTSLAPGSRVVTKYLEKSGLQKNLNTLGFNLVGYGCTTCIGNSGPLNKDIEDDIKNKNLTVAAVLSGNRNFEGR--IHPLVKANYLASPPLVVVYALAGTVQVDLTKDSICKDKNGNNVYLKDIWPTNNEIEDCVRSVVTCEMFMQKYKDVFSGDEHWQK-IKYERGEIYNWDTKSTYIQNPPYFDDLLAGNDKDNVIDIKNARVLAMFGDSVTTDHISPAGNIASNSPAGIYLKNLGIEPQDFNSYGSRRGNHNVMMRGTFANIRIKNEMISNEGGYTKHIPSQETMSIFDTAMRYKEEAVPLVVIAGKEYGAGSSRDWAAKGTLLLGIKAVIAESFERIHRSNLVGMGVLPLIFQGGVTRRIFDSSEIISIKG--EIVPSGNLECIIKRKDNSEQSIQLKCCVQTATEVKYLMSGGVLSYILAQSS |
1B0J Chain:A ((21-748)) | -----------------------------------------------LEKNIDIVRKRLNRPLTLSEKIVYGHLDDPANQEIERGKTYLRLRPDRVAMQDATAQMAMLQFIS--------SGLPKV---AVPSTIHCDHLIEAQLGGE-----KDLRRAKDINQEVYNFLATAGAKY-GVGFWRPGSGIIHQIILENYA----------YPGVLLIGTDSHTPNGGGLGGICIGVGGADAVDVMAGIPWELKCPKVIGVKLTGSLSGWTSPKDVILKVAGILTVKGGTGAIVEYHGPGVDSISCTGMATICNMGAEIGATTSVFPYNHRMKKYLSKTGRAD-IANLADEF-KDHLVPDPG--CHYDQVIEINLSELKPHINGPFTPDLAHPVAEVG-------SVAE-KEGWPL---DIRVGLIGSCTNSSYEDMGRSAA-VAKQALAHGLKCK--SQFTITPGSEQIRATIERDGYAQVLRDVGGIVLANACGPCIGQWD--RKDIKKGEKN-----TIVTSYNRNFTGRNDANPETHA-FVTSPEIVTALAIAGTLKFNPETDFLT-GKDGKKFKLEA--PDADELPRA---------------EFDPGQDTYQHPPKDSSGQRVDVSPTSQRLQ-------LLEPFDKWDGKDLEDLQILIKVKGKCTTDHISAAGP---------WLK--------FRGHLDNISN-NLLI----GAINIENRKANS----VRNAVTQEFGPVPDTARYYKQHGIRWVVIGDENYGEGASREHSALEPRHLGGRAIITKSFARIHETNLKKQGLLPLTFADPADYNKIHPVDKLTIQGLKDFAPGKPLKCIIKHPNGTQETILLNHTF-NETQIEWFRAGSALNRMKELQQ |
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General information:
TITO was launched using:
| RESULT:
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Template: 1B0J.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -318285 for 6582 contacts (-48.4/contact) +
2D Compatibility (PS) -75585 + (NN) -16956 + (LL) 7432
1D Compatibility (HY) -32400 + (ID) 12000
Total energy: -447794.0 ( -68.03 by residue)
QMean score : 0.405
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