Numbat: an interactive software tool for fitting Δχ-tensors to molecular coordinates using pseudocontact shifts-Reference-Cited by-同舟云学术

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Numbat: an interactive software tool for fitting Δχ-tensors to molecular coordinates using pseudocontact shifts

Published:2008-06-24 Issue:3 Volume:41 Page:179-189
ISSN:0925-2738
Container-title:Journal of Biomolecular NMR
language:en
Short-container-title:J Biomol NMR

Author:

Schmitz Christophe,Stanton-Cook Mitchell J.,Su Xun-Cheng,Otting Gottfried,Huber Thomas

Publisher

Springer Science and Business Media LLC

Subject

Spectroscopy,Biochemistry

Link

http://link.springer.com/content/pdf/10.1007/s10858-008-9249-z.pdf

Reference47 articles.

1. Allegrozzi M, Bertini I, Janik MBL, Lee Y-M, Liu G, Luchinat C (2000) Lanthanide-induced pseudocontact shifts for solution structure refinements of macromolecules in shells up to 40 Å from the metal ion. J Am Chem Soc 122:4154–4161

2. Banci L, Dugad LB, La Mar GN, Keating KA, Luchinat C, Pierattelli R (1992) 1H nuclear magnetic resonance investigation of cobalt(II) substituted carbonic anhydrase. Biophys J 63:530–543

3. Banci L, Bertini I, Bren KL, Cremonini MA, Gray HB, Luchinat C, Turano P (1996) The use of pseudocontact shifts to refine solution structures of paramagnetic metalloproteins: Met80Ala cyano-cytochrome c as an example. J Biol Inorg Chem 1:117–126

4. Banci L, Bertini I, Savellini GG, Romagnoli A, Turano P, Cremonini MA, Luchinat C, Gray HB (1997) Pseudocontact shifts as constraints for energy minimization and molecular dynamics calculations on solution structures of paramagnetic metalloproteins. Proteins Struct Funct Genet 29:68–76

5. Banci L, Bertini I, Cremonini MA, Savellini GG, Luchinat C, Wüthrich K, Güntert P (1998) PSEUDYANA for NMR structure calculation of paramagnetic metalloproteins using torsion angle molecular dynamics. J Biomol NMR 12:553–557

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