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Results for submission NMR Assignments of the apo Corynebacterium diphtheria Heme Oxygenase-G135A.

BMRB ID: 15070

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Graph for NMR Assignments of the apo Corynebacterium diphtheria Heme Oxygenase-G135A

Lowest energy structure: S_01076

RMSD against lowest energy structure for all residues

StructureScore
S_01076.pdb12.9450
S_09743.pdb14.3998
S_05528.pdb13.6404
S_07737.pdb11.8255
S_04503.pdb12.9829
S_07655.pdb14.4951
S_00343.pdb12.9983
S_01000.pdb15.8169
S_04843.pdb12.7569
S_06457.pdb14.9344
Averaged Ca-rmsd13.680 +/- 1.207

RMSD against lowest energy structure for residues 54-70

StructureScore
S_01076.pdb2.3041
S_09743.pdb2.4852
S_05528.pdb1.9842
S_07737.pdb2.0985
S_04503.pdb2.3846
S_07655.pdb2.3187
S_00343.pdb2.2230
S_01000.pdb2.4199
S_04843.pdb2.1737
S_06457.pdb2.0862
Averaged Ca-rmsd2.248 +/- 0.162

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