caa a22 4500 477136117 CHVBK 20180405111718.0 cr unu---uuuuu 170330e19970901xx s 000 0 eng 10.1023/A:1018302105638 doi (NATIONALLICENCE)springer-10.1023/A:1018302105638 Protein φ and ψ dihedral restraints determined from multidimensional hypersurface correlations of backbone chemical shifts and their use in the determination of protein tertiary structures [Elektronische Daten] [Richard Beger, Philip Bolton] The chemical shifts of the backbone atoms of proteins can be used to obtainrestraints that can be incorporated into structure determination methods. Eachchemical shift can be used to define a restraint and these restraints can besimultaneously used to define the local, secondary structure features. Theglobal fold can be determined by a combined use of the chemical shift basedrestraints along with the long-range information present in the NOEs ofpartially deuterated proteins or the amide-amide NOEs but not from suchlimited NOE data sets alone. This approach has been demonstrated to be capableof determining the overall folding pattern of four proteins. This suggeststhat solution-state NMR methods can be extended to the structure determinationof larger proteins by using the information present in the chemical shifts ofthe backbone atoms along with the data that can be obtained on a small numberof labeled forms. Kluwer Academic Publishers, 1997 Protein structure nationallicence Chemical shifts nationallicence Dihedral restraints nationallicence Beger Richard Department of Chemistry, Wesleyan University, 06459, Middletown, CT, U.S.A aut Bolton Philip Department of Chemistry, Wesleyan University, 06459, Middletown, CT, U.S.A aut Journal of Biomolecular NMR Kluwer Academic Publishers 10/2(1997-09-01), 129-142 0925-2738 10:2<129 1997 10 10858 https://doi.org/10.1023/A:1018302105638 text/html Onlinezugriff via DOI 1 research-article jats NATIONALLICENCE 856 40 https://doi.org/10.1023/A:1018302105638 text/html Onlinezugriff via DOI NATIONALLICENCE 700 1- Beger Richard Department of Chemistry, Wesleyan University, 06459, Middletown, CT, U.S.A aut NATIONALLICENCE 700 1- Bolton Philip Department of Chemistry, Wesleyan University, 06459, Middletown, CT, U.S.A aut NATIONALLICENCE 773 0- Journal of Biomolecular NMR Kluwer Academic Publishers 10/2(1997-09-01), 129-142 0925-2738 10:2<129 1997 10 10858 Metadata rights reserved Springer special CC-BY-NC licence nationallicence BK010053 XK010053 XK010000 NATIONALLICENCE NATIONALLICENCE NL-springer