Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MTKLPQNFMWGGALAANQFEGGYEKGGKGLSVIDVMTSGAHGKARQITESIDLNHYYPNHEGIDFYHRYKEDIALFKEMGLKCLRTSIAWTRIFPNGDEDVPNEEGLAFYDRIFDELIAQGIEPVVTLSHFEMPLHLAKHYGGFRNREVVDYFVHFARVVFERYKDKVTYWMTFNEINNQMDTSNPIFLWTNSGVALTENDNPE----EVLYQVAHHELLASALAVRLGKEINPKFKIGTMISHVPIYPYSCHPKDMMEAQIANR-LRFFFPDVQVRGYYPSYAKKMLARKGYDVGWQEGDDSILQQGTVDYIGFSYYMSTAVKHDVDTTVENNIVNGGLNHSVENPHIATSDWGWAIDPDGLRYTLNVLYDRY-QLPLFIVENGFGAVDEVV-DGHIHDDYRIEYLKAHITAAIEAVDQDGVDLIGYTPWGIIDIVSFTTGEMKKRYGLIYVDRDNDGHGTMERLKKDSFYWYQQVIASNGDKL |
4PTX Chain:A ((7-444)) | ---FPEDFIWGAATSSYQIEGAFNEDGKGESIWDRFSHTPGKIENGDTGDIACDHY----------HLYREDIELMKEIGIRSYRFSTSWPRILPEGKGRV-NQKGLDFYKRLVDNLLKANIRPMITLYHWDLPQAL-QDKGGWTNRDTAKYFAEYARLMFEEFNGLVDLWVTHNEP----------WVVAFEGHAFG-NHAPGTKDFKTALQVAHHLLLSHGMAVDIFREEDLPGEIGITLNLTPAYPAGDSEKDVKAASLLDDYINAWFLSPVFKGSYPEELHHIYEQNLGAFTTQPGDMDIISR-DIDFLGINYYSRMVVRHKPG----DNLFNAEVVKMEDRP---STEMGWEIYPQGLYDILVRVNKEYTDKPLYITENGAAFDDKLTEEGKIHDEKRINYLGDHFKQAYKAL-KDGVPLRGYYVWSLMDNFEWAYG-YSKRFGLIYVDYENGNR----RFLKDSALWYREVI------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 4PTX.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -231348 for 3808 contacts (-60.8/contact) +
2D Compatibility (PS) -46013 + (NN) -17287 + (LL) 1600
1D Compatibility (HY) -31200 + (ID) 7750
Total energy: -331998.0 ( -87.18 by residue)
QMean score : 0.535
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