Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MTGRCPTVAVVGAGMSGMCVAITLLSAGITDVCIYEKADDVGGTWRDNTYPGLTCDVPSRLYQYSFAKNP----NWTQMFSRGGEIQDYLRGIAERYGLRHRIRFGATVVSARFDD--GRWVLRTDSGTESTVDFLISATGVLHHPRIPPIAGLDDFRGTVFHSARWDHT-VPLLGRRIAVIGTGSTGVQLVCGLAGVAGKVTMFQRTAQWVLPWPN------------PRYSKLARVFHRAFPCLGSLAYK----AYSLSFETFAVALS------NPGL---HRKL---------VGAVCRASLRR-VRDPRLRRALTPDYEPM-CKRLVMSGGFYRAIQRDDVELV---TAGIDHVEHRGIVTDDGVLHEVDVIVLATGFD--SHAFFRPMQLTGRDGIRIDDVWQDGPHAHQTVAIPGFPNFFMMLGPHSPVGNFPLTAVAESQAE----HIVQWIKRWRHGEFDTMEPKSAATEAYNTVLRAAM-PNTV-WTTGCDSWYLNKDGIPEVWPFAPAKHRAMLANLHPEEYDLRRYAAVRATSRPQSA |
1W4X Chain:A ((19-506)) | -------VLVVGAGFSGLYALYRLRELGRS-VHVIETAGDVGGVWYWNRYPGARCDIESIEYCYSFSEEVLQEWNWTERYASQPEILRYINFVADKFDLRSGITFHTTVTAAAFDEATNTWTVDTNHGDRIRARYLIMASGQLSVPQLPNFPGLKDFAGNLYHTGNWPHEPVDFSGQRVGVIGTGSSGIQVSPQIAKQAAELFVFQRTPHFAVPARNAPLDPEFLADLKKRYAEF-REESRNTPG-GTHRYQGPKSALEVSDEELVETLERYWQEGGPDILAAYRDILRDRDANERVAEFIRNKIRNTVRDPEVAERLVPKGYPFGTKRLILEIDYYEMFNRDNVHLVDTLSAPIETITPRGVRTSERE-YELDSLVLATGFDALTGALFK-IDIRGVGNVALKEKWAAGPRTYLGLSTAGFPNLFFIAGPGSPSALSNMLVSIEQHVEWVTDHIAYMFKNGLTRSEAVLEKEDEWVEHVNEIADETLYPMTASWYTGAN------------------------------------------------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 1W4X.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -332804 for 3451 contacts (-96.4/contact) +
2D Compatibility (PS) -46789 + (NN) -19942 + (LL) 3740
1D Compatibility (HY) -28800 + (ID) 7800
Total energy: -432395.0 ( -125.30 by residue)
QMean score : 0.476
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