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Results for submission SOLUTION STRUCTURE OF GROUP IV WW DOMAIN: A.NIDULANS PINA.

BMRB ID: 15003

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Graph for SOLUTION STRUCTURE OF GROUP IV WW DOMAIN: A.NIDULANS PINA

Lowest energy structure: S_05399

RMSD against lowest energy structure for all residues

StructureScore
S_05399.pdb6.9293
S_00285.pdb4.1501
S_07533.pdb3.1079
S_06779.pdb4.1979
S_08115.pdb2.9505
S_07927.pdb4.2306
S_01653.pdb6.9689
S_05827.pdb4.8317
S_01981.pdb6.8484
S_08388.pdb3.5518
Averaged Ca-rmsd4.777 +/- 1.577

RMSD against lowest energy structure for residues 2-34

StructureScore
S_05399.pdb2.4380
S_00285.pdb2.6842
S_07533.pdb1.9879
S_06779.pdb1.9797
S_08115.pdb1.8493
S_07927.pdb1.6160
S_01653.pdb3.2474
S_05827.pdb3.0491
S_01981.pdb3.7976
S_08388.pdb2.1146
Averaged Ca-rmsd2.476 +/- 0.704

This entry was calculated with Rosetta version 3.5 and version 3.2 of the CS-Rosetta Toolbox.

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Citation information:

"Determination of solution structures of proteins up to 40 kDa using CS-Rosetta with sparse NMR data from deuterated samples" Oliver F. Lange; Paolo Rossi; Nikolaos G. Sgourakis; Yifan Song; Hsiau-Wei Lee; James M. Aramini; Asli Ertekin; Rong Xiao; Thomas B. Acton; Gaetano T. Montelione; David Baker; Proceedings of the National Academy of Sciences 109(27) 10873-10878 (2012) doi: 10.1073/pnas.1203013109

"De novo structure generation using chemical shifts for proteins with high-sequence identity but different folds," Yang Shen; Philip N. Bryan; Yanan He; John Orban; David Baker; Ad Bax; Protein Science 19, 349-356 (2010) doi: 10.1002/pro.303

"De novo protein structure generation from incomplete chemical shift assignments," Yang Shen; Robert Vernon; David Baker; Ad Bax; J. Biomol. NMR 43, 63-78 (2009) doi: 10.1007/s10858-008-9288-5

"Consistent blind protein structure generation from NMR chemical shift data," Yang Shen; Oliver Lange; Frank Delaglio; Paolo Rossi; James M. Aramini; Gaohua Liu; Alexander Eletsky; Yibing Wu; Kiran K. Singarapu; Alexander Lemak; Alexandr Ignatchenko; Cheryl H. Arrowsmith; Thomas Szyperski; Gaetano T. Montelione; David Baker; Ad Bax; Proceedings of the National Academy of Sciences 105(12) 4685-4690 (2008) doi: 10.1073/pnas.0800256105