Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MTGRCPTVAVVGAGMSGMCVAITLLSAGITDVCIYEKADDVGGTWRDNTYPGLTCDVPSRLYQYSFAKNP----NWTQMFSRGGEIQDYLRGIAERYGLRHRIRFGATVVSARF--DDGRWVLRTDSGTESTVDFLISATGVLHHPRIPPIAGLDDFRGTVFHSARW-------DHTVPLLGRRIAVIGTGSTGVQLVCGLAGVAGKVTMFQRTAQWVLPWPNPRYSK---------------LARVFHRAFP-----------------CLGSLAYK--AYSLSFETFAVALSNPGLHRKLVGAVCRASLRRVRDPRLRRALTPDYEPM-CKRLVMSGGFYRAIQRDDVELV---TAGIDHVEHRGIVTDDGVLHEVDVIVLATGFDS-HAFFRPMQLTGRDGIRIDDVWQDGPHAHQTVAIPGFPNFFMMLGPHSPVGNFPLTAVAESQAEHIVQWIKRWRHGEFDTMEPKSAATEAYNTVLRAAMPNTVWTTGCDSWYLNKDGIPEVWPFAPAKHRAMLANLHPEEYDLRRYAAVRATSRPQSA |
3UOX Chain:A ((14-510)) | ---------VIGAGVTGIYQAFLINQAGMKVLGI-EAGEDVGGTWYWNRYPGCRLDTESYAYGYFALKGIIPEWEWSENFASQPEMLRYVNRAADAMDVRKHYRFNTRVTAARYVENDRLWEVTLDNEEVVTCRFLISATGPLSA---PDIKGIDSFKGESFHSSRWPTDAEGAPKGVDFTGKRVGVIGTGATGVQIIPIAAETAKELYVFQRTPNWCTPLGNSPMSKEKMDSLRNRYPTILEYVKSTDTAFPYHRDPRKGTDVSESERDAFFEELYRQPGYGIWLSGFRDLLLNKESNKFLADFVAKKIRQRVKDPVVAEKLIPKDHPFGAKRVPMETNYYETYNRDNVHLVDIREAPIQEVTPEGIKTADAA-YDLDVIIYATGFDAVTGSLDRIDIRGKDNVRLIDAWAEGPSTYLGLQARGFPNFFTLVGPHNGSTFCNVGVCGGLQAEWVLRMISYMKDNGFTYSEPTQAAENRWTEEVYADFSRTLLAE-ANAWWVKTTTKPD-------------------------------------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 3UOX.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -338936 for 3625 contacts (-93.5/contact) +
2D Compatibility (PS) -46828 + (NN) -12537 + (LL) 3756
1D Compatibility (HY) -30400 + (ID) 7600
Total energy: -432545.0 ( -119.32 by residue)
QMean score : 0.463
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