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Entry ID	Data summary	Entry Title	Citation Title	Authors
31111	Chemical Shifts: 1 set Spectral_peak_list: 1 set	Chickpea (Cicer arientinum) nodule-specific cysteine-rich peptide NCR13: Solution NMR structure of the isomer with C4:C23, C15:C30, and C10:C28 disulfide bonds	Solution NMR structures of the Chickpea (Cicer arientinum) nodule-specific cysteine-rich peptide NCR13 in two different disulfide bonding patterns	D M Shah, G W Buchko, M Zhou, S LS Velivelli
51943	Chemical Shifts: 1 set	Solution State NMR Chemical Shift Assignments for Yeast Peroxiredoxin Tsa1 mutated S78D - Backbone 1H, 13C, and 15N and ILV methyl groups	Disulfide-Bond-Induced Structural Frustration and Dynamic Disorder in a Peroxiredoxin from MAS NMR	Alicia Vallet, Bjorn M Burmann, Laura Troussicot, Mikael Molin, Paul Schanda
51825	Chemical Shifts: 1 set	Solid-State NMR Assignment of Tsa1 Wild Type, a decameric Peroxiredoxin, in its reduced state	Disulfide-Bond-Induced Structural Frustration and Dynamic Disorder in a Peroxiredoxin from MAS NMR	Alicia Vallet, Bjorn M Burmann, Laura Troussicot, Mikael Molin, Paul Schanda
51788	Chemical Shifts: 1 set	Solid-State NMR Assignment of Tsa1 Wild Type, a decameric Peroxiredoxin, in its native oxidized state	Disulfide-Bond-Induced Structural Frustration and Dynamic Disorder in a Peroxiredoxin from MAS NMR	Alicia Vallet, Bjorn M Burmann, Laura Troussicot, Mikael Molin, Paul Schanda
26334	Chemical Shifts: 1 set	NMR chemical shift assignments for melittin in methanol	alpha-proton Chemical Shift Index and Amide Proton Chemical Shift Temperature Coefficient of Melittin in Methanol: Indicators for a Helix Structure and an Intra-Molecular Hydrogen Bond?	Yoshinori Miura
34735	Chemical Shifts: 1 set Spectral_peak_list: 1 set	Dimeric i-motif from 2'Farabinocytidine-modified TC5	i-Motif folding intermediates with zero-nucleotide loops are trapped by 2'-fluoroarabinocytidine via F...H and O...H hydrogen bonds	Anthony K Mittermaier, Carlos Gonzalez, Christopher Hennecker, Masad J Damha, Miguel Garavis, Modesto Orozco, Roberto El-Khoury, Veronica Macaluso
51358	Chemical Shifts: 1 set Spectral_peak_list: 1 set	1H, 13C and 15N resonance assignments of diglycosylated TSR3 domain of human Thrombospondin-1	O-Fucosylation stabilizes the TSR3 motif in Thrombospondin-1 by interacting with nearby amino acids and protecting a disulfide bond	Alexander Eletsky, Atsuko Ito, James H Prestegard, Jessika Valero-Gonzales, Rajashri Manjunath, Ramon Hurtado-Gurerro, Robert J Woods, Robert S Haltiwanger, Steven J Berardinelli
51356	Chemical Shifts: 2 sets Spectral_peak_list: 1 set	1H, 13C and 15N resonance assignments of fucosylated TSR3 domain of human Thrombospondin-1	O-Fucosylation stabilizes the TSR3 motif in Thrombospondin-1 by interacting with nearby amino acids and protecting a disulfide bond	Alexander Eletsky, Atsuko Ito, James H Prestegard, Jessika Valero-Gonzales, Rajashri Manjunath, Ramon Hurtado-Gurerro, Robert J Woods, Robert S Haltiwanger, Steven J Berardinelli
51351	Chemical Shifts: 1 set Spectral_peak_list: 1 set	1H, 13C and 15N resonance assignments of TSR3 domain of human Thrombospondin-1	O-Fucosylation stabilizes the TSR3 motif in Thrombospondin-1 by interacting with nearby amino acids and protecting a disulfide bond	Alexander Eletsky, Atsuko Ito, James H Prestegard, Jessika Valero-Gonzales, Rajashri Manjunath, Ramon Hurtado-Gurerro, Robert J Woods, Robert S Haltiwanger, Steven J Berardinelli
51342	Chemical Shifts: 1 set	SH2 domain from mouse SH2B1	Improved methodology for protein NMR structure calculation using hydrogen bond restraints and ANSURR validation: The SH2 domain of SH2B1	Andrea M Hounslow, Marym F Albalwi, Mike P Williamson, Nicholas J Fowler, Subin Lee
30979	Chemical Shifts: 1 set	Chickpea (Cicer arientinum) nodule-specific cysteine-rich peptide NCR13: Solution NMR structure of the isomer with C4:C10, C15:C30, and C23:C28 disulfide bonds	Chickpea (Cicer arientinum) nodule-specific cysteine-rich peptide NCR13: Solution NMR structure of the isomer with C4:C10, C15:C30, and C23:C28 disulfide bonds	D M Shah, G W Buchko, M Zhou, S LS Velivelli
50974	Chemical Shifts: 1 set	Average nucleotide chemical shifts of the free full-length RNA from MS2 bacteriophage	Characterizing Hydrogen Bonds in Intact RNA from MS2 Bacteriophage Using Magic Angle Spinning NMR	Amir Goldbourt, Moran Meir, Orr S Lusky
30889	Chemical Shifts: 1 set	Solution NMR Structure of PawS-Derived Peptide PDP-24	Solution NMR and racemic crystallography provide insights into a novel structural class of cyclic plant peptides	Charles S Bond, Colton D Payne, Fatemeh Hajiaghaalipour, Grishma Vadlamani, Hakan S Andersson, Joshua S Mylne, K Johan J Rosengren, Mark F Fisher, Richard J Clark, Taj Muhammad, Ulf Goransson
36385	Chemical Shifts: 1 set	Solution structure of Gaussia Liciferase by NMR	Solution structure of Gaussia Luciferase with five disulfide bonds and identification of a putative coelenterazine binding cavity by heteronuclear NMR.	K Tsuda, N Kobayashi, N Wu, S Unzai, T Saotome, T Yamazaki, Y Kuroda
50246	Chemical Shifts: 1 set	[r(UGGUGGT)]4 G-quadruplex	The origin of the high stability of 3'-terminal uridine tetrads: contributions of hydrogen bonding, stacking interactions, and steric factors evaluated using modified oligonucleotide analogs	Joanna Sarzynska, Karolina Zielinska, Karol Pasternak, Ryszard Kierzek, Witold Andralojc, Zofia Gdaniec
50245	Chemical Shifts: 1 set	[r(UGGUGGC)]4 G-quadruplex	The origin of the high stability of 3'-terminal uridine tetrads: contributions of hydrogen bonding, stacking interactions, and steric factors evaluated using modified oligonucleotide analogs	Joanna Sarzynska, Karolina Zielinska, Karol Pasternak, Ryszard Kierzek, Witold Andralojc, Zofia Gdaniec
50248	Chemical Shifts: 1 set	[r(UGGUGG)(LNA-T)]4 G-quadruplex	The origin of the high stability of 3'-terminal uridine tetrads: contributions of hydrogen bonding, stacking interactions, and steric factors evaluated using modified oligonucleotide analogs	Joanna Sarzynska, Karolina Zielinska, Karol Pasternak, Ryszard Kierzek, Witold Andralojc, Zofia Gdaniec
50249	Chemical Shifts: 1 set	[r(UGGUGGPs)]4 G-quadruplex	The origin of the high stability of 3'-terminal uridine tetrads: contributions of hydrogen bonding, stacking interactions, and steric factors evaluated using modified oligonucleotide analogs	Joanna Sarzynska, Karolina Zielinska, Karol Pasternak, Ryszard Kierzek, Witold Andralojc, Zofia Gdaniec
50244	Chemical Shifts: 1 set	[r(UGGUGG)(2'OMeU)]4 G-quadruplex	The origin of the high stability of 3'-terminal uridine tetrads: contributions of hydrogen bonding, stacking interactions, and steric factors evaluated using modified oligonucleotide analogs	Joanna Sarzynska, Karolina Zielinska, Karol Pasternak, Ryszard Kierzek, Witold Andralojc, Zofia Gdaniec
50247	Chemical Shifts: 1 set	[r(UGGUGG)d(T)]4 G-quadruplex	The origin of the high stability of 3'-terminal uridine tetrads: contributions of hydrogen bonding, stacking interactions, and steric factors evaluated using modified oligonucleotide analogs	Joanna Sarzynska, Karolina Zielinska, Karol Pasternak, Ryszard Kierzek, Witold Andralojc, Zofia Gdaniec
50242	Chemical Shifts: 1 set	Chemical shifts for [r(UGGUGG)d(U)]4 G-quadruplex	The origin of the high stability of 3'-terminal uridine tetrads: contributions of hydrogen bonding, stacking interactions, and steric factors evaluated using modified oligonucleotide analogs	Joanna Sarzynska, Karolina Zielinska, Karol Pasternak, Ryszard Kierzek, Witold Andralojc, Zofia Gdaniec
28095	Chemical Shifts: 1 set	1H, 15N and 13C backbone resonance assignments of wild-type substrate-free beta-phosphoglucomutase from Lactococcus lactis with a cis K145-P146 peptide bond (conformer A)	Allomorphy as a mechanism of post-translational control of enzyme activity	Andrea M Hounslow, Angus J Robertson, Clare R Trevitt, F Aaron Cruz-Navarrete, Henry P Wood, Jonathan P Waltho, Matthew J Cliff, Nicola J Baxter, Samuel R Dix
28096	Chemical Shifts: 1 set	1H, 15N and 13C backbone resonance assignments of wild-type substrate-free beta-phosphoglucomutase from Lactococcus lactis with a trans K145-P146 peptide bond (conformer B)	Allomorphy as a mechanism of post-translational control of enzyme activity	Andrea M Hounslow, Angus J Robertson, Clare R Trevitt, F Aaron Cruz-Navarrete, Henry P Wood, Jonathan P Waltho, Matthew J Cliff, Nicola J Baxter, Samuel R Dix
50026	Chemical Shifts: 1 set	2H,15N,13C-labeled FUS-LC fibrils	Side Chain Hydrogen-Bonding Interactions within Amyloid-like Fibrils Formed by the Low-Complexity Domain of FUS: Evidence from Solid State Nuclear Magnetic Resonance Spectroscopy	Dylan T Murray, Robert Tycko
27714	Chemical Shifts: 1 set	Androgen Receptor (AR) polyQ-derived peptide L4Q8	Side chain to main chain hydrogen bonds stabilize a polyglutamine helix in a transcription factor.	Albert Escobedo, Bahareh Eftekharzadeh, Busra Topal, Daniele Mungianu, Ganeko Bernardo-Seisdedos, Giulio Chiesa, Isabella C Felli, Jesus Garcia, Juan Aranda, Kresten Lindorff-Larsen, Margarida Gairi, Micha Kunze, Modesto Orozco, Oscar Millet, Ramon Crehuet, Roberta Pierattelli, Tammo Diercks, Xavier Salvatella
27715	Chemical Shifts: 1 set	Androgen Receptor (AR) polyQ-derived peptide L4Q12	Side chain to main chain hydrogen bonds stabilize a polyglutamine helix in a transcription factor.	Albert Escobedo, Bahareh Eftekharzadeh, Busra Topal, Daniele Mungianu, Ganeko Bernardo-Seisdedos, Giulio Chiesa, Isabella C Felli, Jesus Garcia, Juan Aranda, Kresten Lindorff-Larsen, Margarida Gairi, Micha Kunze, Modesto Orozco, Oscar Millet, Ramon Crehuet, Roberta Pierattelli, Tammo Diercks, Xavier Salvatella
27716	Chemical Shifts: 1 set	Androgen Receptor (AR) polyQ-derived peptide L4Q16	Side chain to main chain hydrogen bonds stabilize a polyglutamine helix in a transcription factor.	Albert Escobedo, Bahareh Eftekharzadeh, Busra Topal, Daniele Mungianu, Ganeko Bernardo-Seisdedos, Giulio Chiesa, Isabella C Felli, Jesus Garcia, Juan Aranda, Kresten Lindorff-Larsen, Margarida Gairi, Micha Kunze, Modesto Orozco, Oscar Millet, Ramon Crehuet, Roberta Pierattelli, Tammo Diercks, Xavier Salvatella
27717	Chemical Shifts: 1 set	Androgen Receptor (AR) polyQ-derived peptide L4Q20	Side chain to main chain hydrogen bonds stabilize a polyglutamine helix in a transcription factor.	Albert Escobedo, Bahareh Eftekharzadeh, Busra Topal, Daniele Mungianu, Ganeko Bernardo-Seisdedos, Giulio Chiesa, Isabella C Felli, Jesus Garcia, Juan Aranda, Kresten Lindorff-Larsen, Margarida Gairi, Micha Kunze, Modesto Orozco, Oscar Millet, Ramon Crehuet, Roberta Pierattelli, Tammo Diercks, Xavier Salvatella
27713	Chemical Shifts: 1 set	Androgen Receptor (AR) polyQ-derived peptide L4Q4	Side chain to main chain hydrogen bonds stabilize a polyglutamine helix in a transcription factor.	Albert Escobedo, Bahareh Eftekharzadeh, Busra Topal, Daniele Mungianu, Ganeko Bernardo-Seisdedos, Giulio Chiesa, Isabella C Felli, Jesus Garcia, Juan Aranda, Kresten Lindorff-Larsen, Margarida Gairi, Micha Kunze, Modesto Orozco, Oscar Millet, Ramon Crehuet, Roberta Pierattelli, Tammo Diercks, Xavier Salvatella
30536	Chemical Shifts: 1 set Spectral_peak_list: 1 set	Solution structure of gomesin at 310K	The unusual conformation of cross-strand disulfide bonds is critical to the stability of beta-hairpin peptides	Evelyne Deplazes, Glenn F King, Ricardo L Mancera, Yanni K-Y K Chin
30534	Chemical Shifts: 1 set Spectral_peak_list: 1 set	Solution structure of gomesin at 278 K	The unusual conformation of cross-strand disulfide bonds is critical to the stability of beta-hairpin peptides	Evelyne Deplazes, Glenn F King, Ricardo L Mancera, Yanni K-Y K Chin
30535	Chemical Shifts: 1 set Spectral_peak_list: 1 set	Solution structure of gomesin at 298 K	The unusual conformation of cross-strand disulfide bonds is critical to the stability of beta-hairpin peptides	Evelyne Deplazes, Glenn F King, Ricardo L Mancera, Yanni K-Y K Chin
27605	Chemical Shifts: 2 sets	Dynamics of the leucine zipper of Nek2 kinase	Controlling the dynamics of the Nek2 leucine zipper by engineering of "kinetic" disulphide bonds.	Alain Oregioni, Daniel S Gutmans, Karishma Asiani, Mark Pfuhl, R Andrew A Atkinson, Sara B-M B Whittaker
30474	Chemical Shifts: 1 set Spectral_peak_list: 2 sets	De Novo Design of a Protein Heterodimer with Specificity Mediated by Hydrogen Bond Networks	Programmable design of orthogonal protein heterodimers.	Aniruddha Sahasrabuddhe, David Baker, David Flores-Solis, Florian Busch, Frank DiMaio, Lauren P Carter, Matthew J Bick, Mengxuan Jia, Nikolaos G Sgourakis, Peilong Lu, Robert A Langan, Scott E Boyken, Sherry Bermeo, T J Brunette, Vicki H Wysocki, Vikram Khipple K Mulligan, Zachary L VanAernum, Zibo Chen
27390	Chemical Shifts: 1 set	mu-PIIIA-15	Conformational mu-Conotoxin PIIIA Isomers Revisited: Impact of Cysteine Pairing on Disulfide-Bond Assignment and Structure Elucidation	Alesia A Tietze, Anja Resemann, Charlotte A Baeuml, Daniel Tietze, Detlev Suckau, Diana Imhof, Franz J Mayer, Oliver Ohlenschlaeger, Pascal Heimer
27389	Chemical Shifts: 1 set	mu-PIIIA-10	Conformational mu-Conotoxin PIIIA Isomers Revisited: Impact of Cysteine Pairing on Disulfide-Bond Assignment and Structure Elucidation	Alesia A Tietze, Anja Resemann, Charlotte A Baeuml, Daniel Tietze, Detlev Suckau, Diana Imhof, Franz J Mayer, Oliver Ohlenschlaeger, Pascal Heimer
27391	Chemical Shifts: 1 set	mu-PIIIA-14	Conformational mu-Conotoxin PIIIA Isomers Revisited: Impact of Cysteine Pairing on Disulfide-Bond Assignment and Structure Elucidation	Alesia A Tietze, Anja Resemann, Charlotte A Baeuml, Daniel Tietze, Detlev Suckau, Diana Imhof, Franz J Mayer, Oliver Ohlenschlaeger, Pascal Heimer
27384	Chemical Shifts: 1 set	mu-PIIIA-6	Conformational mu-Conotoxin PIIIA Isomers Revisited: Impact of Cysteine Pairing on Disulfide-Bond Assignment and Structure Elucidation	Alesia A Tietze, Anja Resemann, Charlotte A Baeuml, Daniel Tietze, Detlev Suckau, Diana Imhof, Franz J Mayer, Oliver Ohlenschlaeger, Pascal Heimer
27385	Chemical Shifts: 1 set	mu-PIIIA-9	Conformational mu-Conotoxin PIIIA Isomers Revisited: Impact of Cysteine Pairing on Disulfide-Bond Assignment and Structure Elucidation	Alesia A Tietze, Anja Resemann, Charlotte A Baeuml, Daniel Tietze, Detlev Suckau, Diana Imhof, Franz J Mayer, Oliver Ohlenschlaeger, Pascal Heimer
27386	Chemical Shifts: 1 set	mu-PIIIA-11	Conformational mu-Conotoxin PIIIA Isomers Revisited: Impact of Cysteine Pairing on Disulfide-Bond Assignment and Structure Elucidation	Alesia A Tietze, Anja Resemann, Charlotte A Baeuml, Daniel Tietze, Detlev Suckau, Diana Imhof, Franz J Mayer, Oliver Ohlenschlaeger, Pascal Heimer
27388	Chemical Shifts: 1 set	mu-PIIIA-8	Conformational mu-Conotoxin PIIIA Isomers Revisited: Impact of Cysteine Pairing on Disulfide-Bond Assignment and Structure Elucidation	Alesia A Tietze, Anja Resemann, Charlotte A Baeuml, Daniel Tietze, Detlev Suckau, Diana Imhof, Franz J Mayer, Oliver Ohlenschlaeger, Pascal Heimer
27383	Chemical Shifts: 1 set	mu-PIIIA-5	Conformational mu-Conotoxin PIIIA Isomers Revisited: Impact of Cysteine Pairing on Disulfide-Bond Assignment and Structure Elucidation	Alesia A Tietze, Anja Resemann, Charlotte A Baeuml, Daniel Tietze, Detlev Suckau, Diana Imhof, Franz J Mayer, Oliver Ohlenschlaeger, Pascal Heimer
27382	Chemical Shifts: 1 set	mu-PIIIA-4	Conformational mu-Conotoxin PIIIA Isomers Revisited: Impact of Cysteine Pairing on Disulfide-Bond Assignment and Structure Elucidation	Alesia A Tietze, Anja Resemann, Charlotte A Baeuml, Daniel Tietze, Detlev Suckau, Diana Imhof, Franz Mayer, Oliver Ohlenschlaeger, Pascal Heimer
27379	Chemical Shifts: 1 set	mu-PIIIA-3	Conformational mu-Conotoxin PIIIA Isomers Revisited: Impact of Cysteine Pairing on Disulfide-Bond Assignment and Structure Elucidation	Alesia A Tietze, Anja Resemann, Charlotte A Baeuml, Daniel Tietze, Detlev Suckau, Diana Imhof, Franz J Mayer, Oliver Ohlenschlaeger, Pascal Heimer
27366	Chemical Shifts: 1 set	Backbone 1H, 15N chemical shift assignments of Kaiso E535Q zinc finger DNA binding domain in complex with its double CpG-methylated DNA consensus binding site (MeCG2)	CH---O Hydrogen Bonds Mediate Highly Specific Recognition of Methylated CpG steps by the Zinc Finger Protein Kaiso	Evgenia N Nikolova, H Jane Dyson, Peter E Wright, Robyn L Stanfield
27369	Chemical Shifts: 1 set	Backbone 1H, 15N chemical shift assignments of Kaiso E535Q zinc finger DNA binding domain in complex with a double CpG-methylated DNA resembling the specific Kaiso binding site (KBS)	CH---O Hydrogen Bonds Mediate Highly Specific Recognition of Methylated CpG steps by the Zinc Finger Protein Kaiso	Evgenia N Nikolova, H Jane Dyson, Peter E Wright, Robyn L Stanfield
27370	Chemical Shifts: 1 set	Backbone 1H, 15N chemical shift assignments of Kaiso E535A zinc finger DNA binding domain in complex with a double CpG-methylated DNA resembling the specific Kaiso binding site (KBS)	CH---O Hydrogen Bonds Mediate Highly Specific Recognition of Methylated CpG steps by the Zinc Finger Protein Kaiso	Evgenia N Nikolova, H Jane Dyson, Peter E Wright, Robyn L Stanfield
27371	Chemical Shifts: 1 set	Backbone 1H, 15N chemical shift assignments of Kaiso zinc finger DNA binding domain in complex with a semi-CpG-methylated DNA resembling the specific Kaiso binding site (KBS)	CH---O Hydrogen Bonds Mediate Highly Specific Recognition of Methylated CpG steps by the Zinc Finger Protein Kaiso	Evgenia N Nikolova, H Jane Dyson, Peter E Wright, Robyn L Stanfield
27372	Chemical Shifts: 1 set	Backbone 1H, 15N chemical shift assignments of Kaiso zinc finger DNA binding domain in complex with a hemi-CpG-methylated DNA resembling the specific Kaiso binding site (KBS)	CH---O Hydrogen Bonds Mediate Highly Specific Recognition of Methylated CpG steps by the Zinc Finger Protein Kaiso	Evgenia N Nikolova, H Jane Dyson, Peter E Wright, Robyn L Stanfield
27367	Chemical Shifts: 1 set	Backbone 1H, 15N chemical shift assignments of Kaiso E535A zinc finger DNA binding domain in complex with its double CpG-methylated DNA consensus binding site	CH---O Hydrogen Bonds Mediate Highly Specific Recognition of Methylated CpG steps by the Zinc Finger Protein Kaiso	Evgenia N Nikolova, H Jane Dyson, Peter E Wright, Robyn L Stanfield
27368	Chemical Shifts: 1 set	Backbone 1H, 15N chemical shift assignments of Kaiso zinc finger DNA binding domain in complex with a double CpG-methylated DNA resembling the specific Kaiso binding site (KBS)	CH---O Hydrogen Bonds Mediate Highly Specific Recognition of Methylated CpG steps by the Zinc Finger Protein Kaiso	Evgenia N Nikolova, H Jane Dyson, Peter E Wright, Robyn L Stanfield
27364	Chemical Shifts: 1 set	Backbone 1H, 15N chemical shift assignments of Kaiso zinc finger DNA binding domain in complex with its double CpG-methylated DNA consensus binding site (MeCG2)	CH---O Hydrogen Bonds Mediate Highly Specific Recognition of Methylated CpG steps by the Zinc Finger Protein Kaiso	Evgenia N Nikolova, H Jane Dyson, Peter E Wright, Robyn L Stanfield
27330	Chemical Shifts: 1 set	1H, 13C and 15N resonance assignment of SpyCatcher	NMR Spectroscopic Studies Reveal the Critical Role of the Isopeptide Bond in Forming the Otherwise Unstable SpyTag-SpyCatcher Mutant Complexes	Jing Fang, Jing Liu, Nan Zhang, Shenlin Wang, Wen-Bin B Zhang, Wen-Hao H Wu, Xiao-Di D Da, Yajie Liu
27331	Chemical Shifts: 1 set	1H, 13C and 15N resonance assignment of SpyCatcher part of complex	NMR Spectroscopic Studies Reveal the Critical Role of the Isopeptide Bond in Forming the Otherwise Unstable SpyTag-SpyCatcher Mutant Complexes	Jing Fang, Jing Liu, Nan Zhang, Shenlin Wang, Wen-Bin B Zhang, Wen-Hao H Wu, Xiao-Di D Da, Yajie Liu
30339	Chemical Shifts: 1 set Spectral_peak_list: 1 set	Solution structure of Magi3 a specific insect toxin from the spider Macrothele gigas	Successful refolding and NMR structure of rMagi3: An insecticidal spider toxin rich in disulfide bonds.	A Mendoza, E Carrillo, E Lopez-Vera, F C Escobedo-Gonzalez, F del Rio Portilla, G A Titaux-Delgado, G Corzo, M Martinez-Mayorga, P Cano-Sanchez
34174	Chemical Shifts: 1 set	2'F-ANA-G modified quadruplex with a flipped tetrad	Nonconventional C-HF Hydrogen Bonds Support a Tetrad Flip in Modified G-Quadruplexes.	J Dickerhoff, K Weisz
36014	Chemical Shifts: 1 set	Solution structure of the Pin1-PPIase (S138A) mutant	Dynamic Allostery Modulates Catalytic Activity by Modifying the Hydrogen Bonding Network in the Catalytic Site of Human Pin1.	Arif Rashid, Jing Wang, Jun-Ichi I Uewaki, Naoya Tochio, Ryosuke Kawasaki, Shin-Ichi I Tate
26570	Chemical Shifts: 1 set	Backbone and sidechain 1H, 13C and 15N chemical shifts for human superoxide dismutase (hSOD1) lacking bound metal and the intrasubunit disulfide bond	Thermal Fluctuations of Immature SOD1 Lead to Separate Folding and Misfolding Pathways	Ashok Sekhar, Colleen M Doyle, Elizabeth M Meiering, Helen R Broom, Jessica AO Rumfeldt, Lewis E Kay
25575	Chemical Shifts: 1 set	Structure of SAP30L corepressor protein	Redox-dependent disulfide bond formation in SAP30L corepressor protein: Implications for structure and function	Helena Tossavainen, Janne Janis, Jarkko Valjakka, Keijo Viiri, Mikko Laitaoja, Olli Lohi, Perttu Permi, Tero Pihlajamaa
11588	Chemical Shifts: 1 set	Solution structure of Human Pin1 PPIase C113S mutant	Allosteric Breakage of the Hydrogen Bond within the Dual-Histidine Motif in the Active Site of Human Pin1 PPIase	Jing Wang, Jun-ichi Uewaki, Naoko Utsunomiya-Tate, Naoya Tochio, Ning Xu, Ryosuke Kawasaki, Shin-ichi Tate, Yu Tamari
11587	Chemical Shifts: 1 set	Solution structure of Human Pin1 PPIase mutant C113A	Allosteric Breakage of the Hydrogen Bond within the Dual-Histidine Motif in the Active Site of Human Pin1 PPIase	Jing Wang, Jun-ichi Uewaki, Naoko Utsunomiya-Tate, Naoya Tochio, Ning Xu, Ryosuke Kawasaki, Shin-ichi Tate, Yu Tamari
19892	Chemical Shifts: 1 set	REFINED STRUCTURE OF OUTER MEMBRANE PROTEIN X IN NANODISC BY MEASURING RESIDUAL DIPOLAR COUPLINGS	Measuring membrane protein bond orientations in nanodiscs via residual dipolar couplings	C Schwiegk, D Lee, M G Carneiro, R Riek, S Becker, S Bibow, T M Sabo
19722	Chemical Shifts: 1 set	NMR backbone assignment of H83A apo-HasAp from Pseudomonas aeruginosa	Replacing the Axial Ligand Tyrosine 75 or Its Hydrogen Bond Partner Histidine 83 Minimally Affects Hemin Acquisition by the Hemophore HasAp from Pseudomonas aeruginosa.	Hirotoshi Matsumura, Huili Yao, Juan C Rodriguez, Kevin P Battaile, Mario Rivera, Pierre Moenne-Loccoz, Ritesh Kumar, Scott Lovell
19720	Chemical Shifts: 1 set	NMR backbone assignment of WT apo-HasAp from Pseudomonas aeruginosa	Replacing the Axial Ligand Tyrosine 75 or Its Hydrogen Bond Partner Histidine 83 Minimally Affects Hemin Acquisition by the Hemophore HasAp from Pseudomonas aeruginosa.	Hirotoshi Matsumura, Huili Yao, Juan C Rodriguez, Kevin P Battaile, Mario Rivera, Pierre Moenne-Loccoz, Ritesh Kumar, Scott Lovell
19721	Chemical Shifts: 1 set	NMR backbone assignment of Y75A apo-HasAp from Pseudomonas aeruginosa	Replacing the Axial Ligand Tyrosine 75 or Its Hydrogen Bond Partner Histidine 83 Minimally Affects Hemin Acquisition by the Hemophore HasAp from Pseudomonas aeruginosa.	Hirotoshi Matsumura, Huili Yao, Juan C Rodriguez, Kevin P Battaile, Mario Rivera, Pierre Moenne-Loccoz, Ritesh Kumar, Scott Lovell
19663	Chemical Shifts: 1 set	Somatostatin-14 solution structure in 5% D-mannitol	Elucidating the Role of Disulfide Bond on Amyloid Formation and Fibril Reversibility of Somatostatin-14: RELEVANCE TO ITS STORAGE AND SECRETION.	Arunagiri Anoop, Ashutosh Kumar, Bhagwan Das Dhaked, Kumud Agarwal, Mamata Kombrabail, Narendra Nath Jha, Praful Singru, Prasenjit Bhaumik, Ranjith Padinhateeri, Reeba S Jacob, Saikat Ghosh, Samir K Maji, Santosh Kumar, Shruti Sahay, Srivastav Ranganathan, Subhadeep Das, Supriya Pratihar
19275	Chemical Shifts: 1 set	Solution Structure and Activity Study of Bovicin HJ50, a Particular Type AII Lantibiotic	Type AII Lantibiotic Bovicin HJ50 with a Rare Disulfide Bond: Structure, Structure-Activity Relationships and Mode of Action	Jie Zhang, Jinfeng Wang, Jin Zhong, Yingang Feng
19226	Chemical Shifts: 1 set	Structure of 2'F-RNA/2'F-ANA chimeric duplex	Backbone FC(e)H...O Hydrogen Bonds in 2'F-Substituted Nucleic Acids.	Carlos Gonzalez, Glen F Deleavey, Guillem Portella, Masad J Damha, Modesto Orozco, Nerea Martin-Pintado, Ramon Campos-Olivas
21033	Chemical Shifts: 1 set	Solution structure of Lewis x (Gal-beta1,4-[Fuc-alpha1,3]-GlcNAc-beta) attached to a protein	Stabilization of Branched Oligosaccharides: Lewis(x) Benefits from a Nonconventional C-H...O Hydrogen Bond	Beat Ernst, Brian Cutting, Frederic H-T Allain, Mario Schubert, Martin Smiesko, Mirko Zierke, Said Rabbani, Thomas Aeschbacher
18873	Chemical Shifts: 1 set	Chemical shift assignment for Lewisx with a (CH2)3NH2 spacer	Stabilization of Branched Oligosaccharides: Lewis(x) Benefits from a Nonconventional C-H...O Hydrogen Bond	Beat Ernst, Brian Cutting, Frederic H-T Allain, Mario Schubert, Martin Smiesko, Mirko Zierke, Said Rabbani, Thomas Aeschbacher
18750	Chemical Shifts: 3 sets	Chemical shift of E coli. IscU Prolyl residues in S-states	Metamorphic Protein IscU Changes Conformation by cis-trans Isomerizations of Two Peptidyl-Prolyl Peptide Bonds.	John L Markley, Marco Tonelli, Ziqi Dai
18754	Chemical Shifts: 3 sets	Chemical shift of E coli. IscU Prolyl residues in D-states	Metamorphic Protein IscU Changes Conformation by cis-trans Isomerizations of Two Peptidyl-Prolyl Peptide Bonds.	John L Markley, Marco Tonelli, Ziqi Dai
18493	Chemical Shifts: 1 set	High resolution structure of DsbB C41S by joint calculation with solid-state NMR and X-ray data	Structure of the disulfide bond generating membrane protein DsbB in the lipid bilayer.	Anna E Nesbitt, Chad M Rienstra, Charles D Schwieters, Deborah A Berthold, Lindsay J Sperling, Ming Tang, Robert B Gennis
18230	Chemical Shifts: 1 set Heteronuclear NOE Values: 3 sets T1 Relaxation Values: 3 sets T2 Relaxation Values: 3 sets	Solution structure and dynamics of human S100A1 protein modified at cysteine 85 with homocysteine disulfide bond formation in calcium saturated form.	Impact of calcium binding and thionylation of S100A1 protein on its nuclear magnetic resonance-derived structure and backbone dynamics.	Andrzej Bierzyski, Andrzej Ejchart, Katarzyna Ruszczyska-Bartnik, Konrad Zdanowski, Lukasz Jaremko, Mariusz Jaremko, Micha Nowakowski, Monika Budziska
17821	Chemical Shifts: 1 set	Human C30S/C59S-Cox17 mutant	Functional role of two interhelical disulfide bonds in human Cox17 protein from a structural perspective.	Angelo Gallo, Chiara Cefaro, Ivano Bertini, Lucia Banci, Simone Ciofi-Baffoni
17698	Chemical Shifts: 1 set Heteronuclear NOE Values: 3 sets Spectral_peak_list: 1 set	HP67 H41F	On unsatisfied hydrogen bonds in the N-terminal subdomain of villin headpiece	Christopher J McKnight, Jeffrey W Brown, Jeremiah D Farelli
17223	Chemical Rates: 1 set	Measurement of bond vector orientations in invisible excited states of proteins	Measurement of bond vector orientations in invisible excited states of proteins	D F Hansen, Elliott Stollar, Eva Meirovitch, Lewis E Kay, Pramodh Vallurupalli
17032	Chemical Shifts: 1 set Heteronuclear NOE Values: 1 set Spectral_peak_list: 2 sets	1H, 13C, and 15N chemical shifts and structure of brazzein-derived peptide CKR-PNG	Structural role of the terminal disulfide bond in the sweetness of brazzein.	Emeline Maillet, Fariba Assadi-Porter, Hongyu Rao, Jeniffer Quijada, John L Markley, Marco Tonelli, Marianna Max, Sannali M Dittli
16978	Chemical Shifts: 1 set Heteronuclear NOE Values: 1 set Spectral_peak_list: 2 sets	1H, 15N, 13C chemical shifts and structure of CKR-brazzein	Structural role of the terminal disulfide bond in the sweetness of brazzein.	Emeline Maillet, Fariba Assadi-Porter, Hongyu Rao, Jeniffer Quijada, John L Markley, Marco Tonelli, Marianna Max, Sannali M Dittli
16962	Coupling Constants: 10 sets	1J and 2J coupling constants in human oxidized ERp18	One-bond and two-bond j couplings help annotate protein secondary-structure motifs: J-coupling indexing applied to human endoplasmic reticulum protein ERp18.	Frank Lohr, Jurgen M Schmidt, Mark J Howard, Michelle L Rowe, Richard A Williamson, Shen Zhou
16898	Chemical Shifts: 1 set	Backbone 1H, 13C and 15N Chemical Shift Assignments for the alpha chain of human haemoglobin bound to alpha-haemoglobin stabilizing protein (AHSP)	-Hemoglobin-stabilizing protein (AHSP) perturbs the proximal heme pocket of oxy--hemoglobin and weakens the iron-oxygen bond.	Anne M Rich, Claire F Dickson, Daniel AT Lowry, Eugene Olson, Jason A Mollan, Joel P Lay, John S Weiss, Mitchell J Mackay, Peter A Gell, Todd L Khandros, William MH Collins
20122	Chemical Shifts: 1 set Conformer_family_coord_set: 1 set	Solution structure of CCAP-vil with one disulfide bond from Conus villepinii	An unusual peptide from Conus villepinii: synthesis, solution structure, and cardioactivity	Alesia Miloslavina, Christina Ebert, Christoph Englert, Daniel Tietze, Diana Imhof, Matthias Goerlach, Oliver Ohlenschlaeger
16327	Chemical Shifts: 1 set	DsbA wild type oxidized	Assignment Strategies for Large Proteins by Magic-Angle Spinning NMR: The 21-kDa Disulfide-Bond-Forming Enzyme DsbA	Chad M Rienstra, Deborah A Berthold, Lindsay J Sperling, Terry L Sasser, Victoria J Jeisy-Scott
16140	Chemical Shifts: 1 set	[Sec13,Sec14]-kappa-hexatoxin-Hv1c	Direct visualization of disulfide bonds through diselenide proxies using 77Se NMR spectroscopy.	Aline Dantas de Araujo, Glenn F King, Graham M Nicholson, Gregory K Pierens, Lynette K Lambert, Mehdi Mobli, Monique J Windley, Paul F Alewood
11062	Chemical Shifts: 1 set	Solution structure of mouse lipocalin-type prostaglandin D synthase possessing a intrinsic disulfide bond.	Structural analysis of lipocalin-type prostaglandin D synthase complexed with biliverdin by small-angle X-ray scattering and multi-dimensional NMR	Ayano Fukuhara, Katsuaki Inoue, Mao Yamada, Naoto Yagi, Shigenori Nishimura, Shigeru Shimamoto, Tadayasu Ohkubo, Takashi Inui, Takuya Yoshida, Yoshihiro Urade, Yuya Miyamoto
15966	Chemical Shifts: 1 set	Solution NMR structure of integral membrane protein DsbB	NMR solution structure of the integral membrane enzyme DsbB: functional insights into DsbB-catalyzed disulfide bond formation.	David S Cafiso, Hiroshi Kadukura, Jeffrey F Ellena, John H Bushweller, Jon Beckwith, Ricardo H Flores Jimenez, Stephen M Lukasik, Tomasz Cierpicki, Yunpeng Zhou
15909	Coupling Constants: 4 sets	1J coupling constants related to the Ca carbons in DFPase from Loligo vulgaris	Variation in protein C(alpha)-related one-bond J couplings	Carlos S Perez, Frank Lohr, Jurgen M Schmidt, Mark J Howard, Mitcheell Maestre-Martinez
15908	Coupling Constants: 4 sets	1J coupling constants related to the Ca carbons in Xylanase from Bacillus agaradhaerens	Variation in protein C(alpha)-related one-bond J couplings	Carlos S Perez, Frank Lohr, Jurgen M Schmidt, Mark J Howard, Mitcheell Maestre-Martinez
15907	Coupling Constants: 4 sets	1J coupling constants related to the Ca carbons in human Ubiquitin	Variation in protein C(alpha)-related one-bond J couplings	Carlos S Perez, Frank Lohr, Jurgen M Schmidt, Mark J Howard, Mitcheell Maestre-Martinez
15906	Coupling Constants: 4 sets	1J coupling constants related to the Ca carbons in human Frataxin C-terminal domain (90-210)	Variation in protein C(alpha)-related one-bond J couplings	Carlos S Perez, Frank Lohr, Jurgen M Schmidt, Mark J Howard, Mitcheell Maestre-Martinez
15905	Coupling Constants: 4 sets	1J coupling constants related to the Ca carbons in Ribonuclease T1 from Aspergillus oryzae	Variation in protein C(alpha)-related one-bond J couplings	Carlos S Perez, Frank Lohr, Jurgen M Schmidt, Mark J Howard, Mitcheell Maestre-Martinez
15904	Coupling Constants: 4 sets	1J coupling constants related to the Ca carbons in oxidised Flavodoxin from Desulfovibrio vulgaris (Hildenborough)	Variation in protein C(alpha)-related one-bond J couplings	Carlos S Perez, Frank Lohr, Jurgen M Schmidt, Mark J Howard, Mitcheell Maestre-Martinez
15897	Chemical Shifts: 1 set	Solution structures of copper loaded form PCuA (cis conformation of the peptide bond involving the nitrogen of P14)	Mechanism of Cu(A) assembly.	Alejandro J Vila, Georgios A Spyroulias, Ivano Bertini, Lucia Banci, Luciano A Abriata, Petros A Gkazonis, Shenlin Wang, Simone Ciofi-Baffoni
15896	Chemical Shifts: 1 set	Solution structures of copper loaded form PCuA (trans conformation of the peptide bond involving the nitrogen of P14)	Mechanism of Cu(A) assembly.	Alejandro J Vila, Georgios A Spyroulias, Ivano Bertini, Lucia Banci, Luciano A Abriata, Petros Gkazonis, Shenlin Wang, Simone Ciofi-Baffoni
15895	Chemical Shifts: 1 set	Solution structures of apo form PCuA (cis conformation of the peptide bond involving the nitrogen of P14)	Mechanism of Cu(A) assembly.	Alejandro J Vila, Georgios A Spyroulias, Ivano Bertini, Lucia Banci, Luciano A Abriata, Petros Gkazonis, Shenlin Wang, Simone Ciofi-Baffoni
15679	Chemical Shifts: 1 set	3D NMR structure of domain cC0 of cardiac myosin bonding protein C (MyBP-C)	Structure and interactions of myosin-binding protein C domain C0: cardiac-specific regulation of myosin at its neck?	Elena Rostkova, Joyce Ratti, Mark Pfuhl, Mathias Gautel
15232	Chemical Shifts: 1 set	proline-free mutant of SNase V8	Restricted backbone conformational and motional flexibilities of loops containing peptidyl-proline bonds dominate the enzyme activity of staphylococcal nuclease(,).	Jinfeng Wang, Lu Shan, Min Wang, Tao Xie, Yufeng Tong
15215	Chemical Shifts: 1 set	Solution structure of the alternative conformation of XCL1/Lymphotactin	An engineered second disulfide bond restricts lymphotactin/XCL1 to a chemokine-like conformation with XCR1 agonist activity	A J Pelzek, B F Volkman, E S Elgin, F C Peterson, R L Tuinstra
15110	Chemical Shifts: 1 set	Solution structure of V21C/V59C Lymphotactin/XCL1	An engineered second disulfide bond restricts lymphotactin/XCL1 to a chemokine-like conformation with XCR1 agonist activity	A J Pelzek, B F Volkman, E S Elgin, F C Peterson, R L Tuinstra
15047	Chemical Shifts: 1 set	Ubiquitin in 8 M Urea	Direct Observation of Dipolar Couplings and Hydrogen Bonds across a beta-hairpin in 8 M Urea	Mark Strohmeier, Martin Blackledge, Sebastian Meier, Stephan Grzesiek
7135	Chemical Shifts: 1 set	Assignments of 2SSalpha in 8M urea, pH 2, 293 K	Characterisation of Disulfide Bond Dynamics in Non-Native States of Lysozyme and its Disulfide Deletion Mutants by NMR	Christopher M Dobson, Emily S Collins, Harald Schwalbe, Hideki Tachibana, Julia Wirmer, Kenichi Hirai, Shin-ichi Segawa
7136	Chemical Shifts: 1 set	Assignments of 2SSbeta in 8M urea, pH 2, 293 K	Characterisation of Disulfide Bond Dynamics in Non-Native States of Lysozyme and its Disulfide Deletion Mutants by NMR	Christopher M Dobson, Emily S Collins, Harald Schwalbe, Hideki Tachibana, Julia Wirmer, Kenichi Hirai, Shin-ichi Segawa
6660	Chemical Shifts: 1 set	15N hyperfine shifts assignment for rubredoxin (V8A) from Clostridium pasteurianum in the oxidized state	Changes in hydrogen-bond strengths explain reduction potentials in 10 rubredoxin variants.	Erika Gebel, I-Jin Lin, John L Markley, Timothy Machonkin, William Westler
6659	Chemical Shifts: 1 set	15N hyperfine shifts assignment for wild-type rubredoxin from Clostridium pasteurianum in the oxidized state	Changes in hydrogen-bond strengths explain reduction potentials in 10 rubredoxin variants.	Erika Gebel, I-Jin Lin, John L Markley, Timothy Machonkin, William Westler
6668	Chemical Shifts: 1 set	15N hyperfine shifts assignment for rubredoxin (V8I) from Clostridium pasteurianum in the oxidized state	Changes in hydrogen-bond strengths explain reduction potentials in 10 rubredoxin variants.	Erika Gebel, I-Jin Lin, John L Markley, Timothy Machonkin, William Westler
6678	Chemical Shifts: 1 set	15N hyperfine shifts assignment for rubredoxin (V44L) from Clostridium pasteurianum in the reduced state	Changes in hydrogen-bond strengths explain reduction potentials in 10 rubredoxin variants.	Erika Gebel, I-Jin Lin, John L Markley, Timothy Machonkin, William Westler
6677	Chemical Shifts: 1 set	15N hyperfine shifts assignment for rubredoxin (V44L) from Clostridium pasteurianum in the oxidized state	Changes in hydrogen-bond strengths explain reduction potentials in 10 rubredoxin variants.	Erika Gebel, I-Jin Lin, John L Markley, Timothy Machonkin, William Westler
6676	Chemical Shifts: 1 set	15N hyperfine shifts assignment for rubredoxin (V44I)from Clostridium pasteurianum in the reduced state	Changes in hydrogen-bond strengths explain reduction potentials in 10 rubredoxin variants.	Erika Gebel, I-Jin Lin, John L Markley, Timothy Machonkin, William Westler
6675	Chemical Shifts: 1 set	15N hyperfine shifts assignment for rubredoxin (V44I)from Clostridium pasteurianum in the oxidized state	Changes in hydrogen-bond strengths explain reduction potentials in 10 rubredoxin variants.	Erika Gebel, I-Jin Lin, John L Markley, Timothy Machonkin, William Westler
6674	Chemical Shifts: 1 set	15N hyperfine shifts assignment for rubredoxin (V44G)from Clostridium pasteurianum in the reduced state	Changes in hydrogen-bond strengths explain reduction potentials in 10 rubredoxin variants.	Erika Gebel, I-Jin Lin, John L Markley, Timothy Machonkin, William Westler
6673	Chemical Shifts: 1 set	15N hyperfine shifts assignment for rubredoxin (V44G)from Clostridium pasteurianum in the oxidized state	Changes in hydrogen-bond strengths explain reduction potentials in 10 rubredoxin variants.	Erika Gebel, I-Jin Lin, John L Markley, Timothy Machonkin, William Westler
6672	Chemical Shifts: 1 set	15N hyperfine shifts assignment for rubredoxin (V44A) from Clostridium pasteurianum in the reduced state	Changes in hydrogen-bond strengths explain reduction potentials in 10 rubredoxin variants.	Erika Gebel, I-Jin Lin, John L Markley, Timothy Machonkin, William Westler
6671	Chemical Shifts: 1 set	15N hyperfine shifts assignment for rubredoxin (V44A) from Clostridium pasteurianum in the oxidized state	Changes in hydrogen-bond strengths explain reduction potentials in 10 rubredoxin variants.	Erika Gebel, I-Jin Lin, John L Markley, Timothy Machonkin, William Westler
6670	Chemical Shifts: 1 set	15N hyperfine shifts assignment for rubredoxin (V8L) from Clostridium pasteurianum in the reduced state	Changes in hydrogen-bond strengths explain reduction potentials in 10 rubredoxin variants.	Erika Gebel, I-Jin Lin, John L Markley, Timothy Machonkin, William Westler
6669	Chemical Shifts: 1 set	15N hyperfine shifts assignment for rubredoxin (V8L) from Clostridium pasteurianum in the oxidized state	Changes in hydrogen-bond strengths explain reduction potentials in 10 rubredoxin variants.	Erika Gebel, I-Jin Lin, John L Markley, Timothy Machonkin, William Westler
6667	Chemical Shifts: 1 set	15N hyperfine shifts assignment for rubredoxin (V8I) from Clostridium pasteurianum in the oxidized state	Changes in hydrogen-bond strengths explain reduction potentials in 10 rubredoxin variants.	Erika Gebel, I-Jin Lin, John L Markley, Timothy Machonkin, William Westler
6666	Chemical Shifts: 1 set	15N hyperfine shifts assignment for rubredoxin (V8G/V44G) from Clostridium pasteurianum in the reduced state	Changes in hydrogen-bond strengths explain reduction potentials in 10 rubredoxin variants.	Erika Gebel, I-Jin Lin, John L Markley, Timothy Machonkin, William Westler
6665	Chemical Shifts: 1 set	15N hyperfine shifts assignment for rubredoxin (V8G/V44G) from Clostridium pasteurianum in the oxidized state	Changes in hydrogen-bond strengths explain reduction potentials in 10 rubredoxin variants.	Erika Gebel, I-Jin Lin, John L Markley, Timothy Machonkin, William Westler
6664	Chemical Shifts: 1 set	15N hyperfine shifts assignment for rubredoxin (V8G)from Clostridium pasteurianum in the reduced state	Changes in hydrogen-bond strengths explain reduction potentials in 10 rubredoxin variants.	Erika Gebel, I-Jin Lin, John L Markley, Timothy Machonkin, William Westler
6663	Chemical Shifts: 1 set	15N hyperfine shifts assignment for rubredoxin (V8G)from Clostridium pasteurianum in the oxidized state	Changes in hydrogen-bond strengths explain reduction potentials in 10 rubredoxin variants.	Erika Gebel, I-Jin Lin, John L Markley, Timothy Machonkin, William Westler
6662	Chemical Shifts: 1 set	15N hyperfine shifts assignment for wild-type rubredoxin from Clostridium pasteurianum in the reduced state	Changes in hydrogen-bond strengths explain reduction potentials in 10 rubredoxin variants.	Erika Gebel, I-Jin Lin, John L Markley, Timothy Machonkin, William Westler
6661	Chemical Shifts: 1 set	15N hyperfine shifts assignment for rubredoxin (V8A) from Clostridium pasteurianum in the reduced state	Changes in hydrogen-bond strengths explain reduction potentials in 10 rubredoxin variants.	Erika Gebel, I-Jin Lin, John L Markley, Timothy Machonkin, William Westler
6576	Chemical Shifts: 2 sets Coupling Constants: 1 set	Backbone and sidechain 1H assignments of Crotamine	Automated NMR structure determination and disulfide bond identification of the myotoxin crotamine from Crotalus durissus terrificus	Eduardo B Oliveira, Kurt Wuthrich, Pascal Bettendorff, Tetsuo Yamane, Torsten Herrmann, Valmir Fadel, Walter F de Azevedo
6487	Residual Dipolar Couplings: 2 sets	Determination of Relative N-HN, N-C', CA-C', and CA-HA Effective Bond Length in a Protein by NMR in a Dilute Liquid Crystalline Phase	Determination of Relative N-HN, N-C', CA-C', and CA-HA Effective Bond Length in a Protein by NMR in a Dilute Liquid Crystalline Phase	Ad Bax, Marcel Ottiger
6491	Coupling Constants: 1 set	Correlations among 1JNC and H3JNC Coupling Constants in the Hydrogen-Bonding Network of Human Ubiquitin	Correlations among 1JNC and H3JNC Coupling Constants in the Hydrogen-Bonding Network of Human Ubiquitin	Nenad Juranic, Slobodan Macura
6200	Chemical Shifts: 1 set	Assignment of the minicollagen 1 cysteine rich domain	Determination of a high-precision NMR structure of the minicollagen cysteine rich domain from Hydra and characterization of its disulfide bond formation	Daniel Haussinger, Elena Pokidysheva, Hans P Bachinger, Sebastian Meier, Stephan Grzesiek
6160	Chemical Shifts: 1 set	Structural and biochemical evidence for disulfide bond heterogeneity in active forms of the somatomedin B domain of human vitronectin	Disulfide Bonding Arrangements in Active Forms of the Somatomedin B Domain of Human Vitronectin	A Jagielska, D Loskutoff, G Kroon, H Dyson, H Scheraga, J Neels, M Churchill, P Dawson, R De Guzman, S Curriden, S Oldziej, Y Kamikubo
5724	Chemical Shifts: 1 set Coupling Constants: 1 set	Backbone 1H, 13C, and 15N Chemical Shift Assignments for R43A Brazzein	Correlation of the Sweetness of Variants of the Protein Brazzein with Patterns of Hydrogen Bonds Detected by NMR Spectroscopy	Fariba M Assadi-Porter, Frits Abilgaard, Heike Blad, John L Markley
5723	Chemical Shifts: 1 set Coupling Constants: 1 set	Backbone 1H, 13C, and 15N Chemical Shift Assignments for Brazzein	Correlation of the Sweetness of Variants of the Protein Brazzein with Patterns of Hydrogen Bonds Detected by NMR Spectroscopy	Fariba M Assadi-Porter, Frits Abilgaard, Heike Blad, John L Markley
5725	Chemical Shifts: 1 set Coupling Constants: 1 set	Backbone 1H, 13C, and 15N Chemical Shift Assignments for Ala2ins Brazzein	Correlation of the Sweetness of Variants of the Protein Brazzein with Patterns of Hydrogen Bonds Detected by NMR Spectroscopy	Fariba M Assadi-Porter, Frits Abilgaard, Heike Blad, John L Markley
5726	Chemical Shifts: 1 set Coupling Constants: 1 set	Backbone 1H, 13C, and 15N Chemical Shift Assignments for D50A Brazzein	Correlation of the Sweetness of Variants of the Protein Brazzein with Patterns of Hydrogen Bonds Detected by NMR Spectroscopy	Fariba M Assadi-Porter, Frits Abilgaard, Heike Blad, John L Markley
5727	Chemical Shifts: 1 set Coupling Constants: 1 set	Backbone 1H, 13C, and 15N Chemical Shift Assignments for H31A Brazzein	Correlation of the Sweetness of Variants of the Protein Brazzein with Patterns of Hydrogen Bonds Detected by NMR Spectroscopy	Fariba M Assadi-Porter, Frits Abilgaard, Heike Blad, John L Markley
5728	Chemical Shifts: 1 set Coupling Constants: 1 set	Backbone 1H, 13C, and 15N Chemical Shift Assignments for R33A Brazzein	Correlation of the Sweetness of Variants of the Protein Brazzein with Patterns of Hydrogen Bonds Detected by NMR Spectroscopy	Fariba M Assadi-Porter, Frits Abilgaard, Heike Blad, John L Markley
5613	Chemical Shifts: 1 set	A minimal beta-hairpin peptide scaffold for beta-turn display	Stability of cyclic beta-hairins: asymmetric contributions from side chains of a hydrogen-bonded cross-strand residue pair	A G Cochran, N J Skelton, S J Russell, T Blandl
5612	Coupling Constants: 1 set	Structure of the Plant Defensin PhD1 from Petunia Hybrida	Structure of Petunia hybrida Defensin 1, a Novel Plant Defensin with Five Disulfide Bonds	B JC Janssen, D J Craik, F T Lay, H J Schirra, M A Anderson
5601	Chemical Shifts: 3 sets Coupling Constants: 2 sets	Complete 1H,13C,15N assignments of zinc Pyrococcus furiosus rubredoxin	Hydrogen Bonds in Rubredoxins from Mesophilic and Hyperthermophilic Organisms	Catherine M Bougault, James H Prestegard, Marly K Eidsness
5600	Chemical Shifts: 2 sets Coupling Constants: 2 sets	Complete 1H,13C,15N assignments of zinc Clostridium pasteurianum rubredoxin	Hydrogen Bonds in Rubredoxins from Mesophilic and Hyperthermophilic Organisms	Catherine M Bougault, James H Prestegard, Marly K Eidsness
5470	Chemical Shifts: 1 set	Inhibitory Specificity Change of Ovomucoid Third Domain of Silver Pheasant upon Introduction of an Engineered Cys14-Cys39 Bond	Inhibitory Specificity Change of Ovomucoid Third Domain of Silver Pheasant upon Introduction of an Engineered Cys14-Cys39 Bond	Fumikazu Shinohara, Hideyoshi Yokosawa, Hikaru Hemmi, Kin-ichiro Miura, Masataka Katsu, Shuichi Kojima, Takashi Kumazaki, Takuya Yoshida, Toshimasa Yamazaki, Yoshimasa Kyogoku, Yuji Kobayashi
5469	Chemical Shifts: 1 set	Inhibitory Specificity Change of Ovomucoid Third Domain of Silver Pheasant upon Introduction of an Engineered Cys14-Cys39 Bond	Inhibitory Specificity Change of Ovomucoid Third Domain of Silver Pheasant upon Introduction of an Engineered Cys14-Cys39 Bond	Fumikazu Shinohara, Hideyoshi Yokosawa, Hikaru Hemmi, Kin-ichiro Miura, Masataka Katsu, Shuichi Kojima, Takashi Kumazaki, Takuya Yoshida, Toshimasa Yamazaki, Yoshimasa Kyogoku, Yuji Kobayashi
5282	Chemical Shifts: 1 set	Refinement of d(GCGAAGC) Hairpin Structure Using One- and Two-Bonds Residual Dipolar Couplings	Refinement of d(GCGAAGC) Hairpin Structure Using One- and Two-bond Residual Dipolar Couplings	L Kralik, L Zidek, P Padrta, R Stefl, V Sklenar
4979	Chemical Shifts: 1 set	1H and 13C chemical shift assignments for the pheromone Er-23 from Euplotes raikovi	Communication: NMR structure of the Euplotes raikovi pheromone Er-23 and identification of its five disulfide bonds	Claudio Ortenzi, Fred F Damberger, Kurt Wuthrich, Pierangelo Luporini, Ralph Zahn
4974	Chemical Shifts: 1 set	Rapid Protein fold Determination using Secondary Chemical Shifts and Cross- hydrogen bond 15N-13C' Scalar Couplings (3hbJNC')	Rapid Protein fold Determination using Secondary Chemical Shifts and Cross- hydrogen bond 15N-13C' Scalar Couplings (3hbJNC')	Alexandre MJJ Bonvin, Klaartje Houben, Marc Guenneugues, Robert Kaptein, Rolf Boelens
4853	Chemical Shifts: 1 set	1H Chemical Shift Assignment for the Major Conformer in Solution of the Alpha-like Scorpion Toxin LqhIII	A Cis-trans Isomerism of a Non-prolyl Peptide Bond in Lqh III Alpha-like Scorpion Toxin Revealed by Solution NMR	I Krimm, J M Lancelin, X Trivelli
4640	Chemical Shifts: 1 set	Solution structure and activity of the four disulfide bond Mediterranean mussel defensin MGD-1	Solution structure and activity of the four disulfide bond Mediterranean mussel defensin MGD-1	A Aumelas, A Chavanieu, B Calas, G Mitta, J F Sanchez, P Roch, Y S Yang
4754	Chemical Shifts: 4 sets	Determination of the three dimensional structure of the synthetic 113Cd3-beta-C domain of lobster MT-1 by Nuclear Magnetic Resonance	Structure of the 113Cd3 Beta Domains from Homarus americanus Metallothionein-1: Hydrogen bonding and Solvent Accessibility of Sulfur Atoms	Amalia Munoz, C Frank Shaw, David H Petering, F Holger Forsterling
4725	Chemical Shifts: 4 sets Coupling Constants: 1 set	Determination of the three dimensional structure and HN--S hydrogen bonding of the synthetic 113Cd3-beta-N domain of lobster MT-1 by Nuclear Magnetic Resonance	Structure of the 113Cd3 Beta Domains from Homarus americanus Metallothionein-1: Hydrogen bonding and Solvent Accessibility of Sulfur Atoms	Amalia Munoz, C Frank Shaw, David H Petering, F Holger Forsterling
4686	Chemical Shifts: 1 set Coupling Constants: 1 set	The Human CC Chemokine I-309, Structural Consequences of the Additional Disulfide Bond.	Human CC Chemokine I-309, Structural Consequences of the Additional Disulfide Bond.	Brian D Sykes, Carolyn M Slupsky, David W Keizer, Ian Clark-Lewis, Matthew P Crump, Tae Woo Lee
4461	Chemical Shifts: 1 set	1H NMR Solution Structure of Cycloviolacin O1 - A Macro-cyclic Polypeptide Isolated from Viola odorat	Plant Cyclotides - a unique family of cyclic and knotted proteins that defines the cyclic cystine knot structural moti	Clement Waine, David J Craik, Norelle L Daly, Trudy Bond
4500	Chemical Shifts: 1 set	w-conotoxin MVIIC from Conus magus	Structure-Activity relationships of w-conotoxins MVIIA, MVIIC and 14 loop splice hybrids at N- and P/Q-type calcium channel	D Adams, D J Craik, K J Nielsen, L Thomas, P F Alewood, R J Lewis, T Bond
4137	Chemical Shifts: 2 sets H Exchange Rates: 1 set	Amplification of One-Bond 1H/2H Isotope Efects on 15N Chemical Shifts in Clostridium pasteurianum Rubredoxin by Fermi-Contact Effects Through Hydrogen Bonds --Fe(II)	Amplification of One-Bond 1H/2H Isotope Efects on 15N Chemical Shifts in Clostridium pasteurianum Rubredoxin by Fermi-Contact Effects Through Hydrogen Bonds	Bin Xia, John L Markley, Steven J Wilkens, William M Westler
4066	Chemical Shifts: 2 sets	Amplification of One-Bond 1H/2H Isotope Efects on 15N Chemical Shifts in Clostridium pasteurianum Rubredoxin by Fermi-Contact Effects through Hydrogen Bonds --Fe(III)	Amplification of One-Bond 1H/2H Isotope Efects on 15N Chemical Shifts in Clostridium pasteurianum Rubredoxin by Fermi-Contact Effects through Hydrogen Bonds	Bin Xia, John L Markley, Steven J Wilkens, William M Westler
4054	Chemical Shifts: 1 set	Alpha-Helical Coiled Coil Trimerization Domain of Chicken Cartilage Matrix Protein (Reduced C5-C7 Disulfide Bonds)	Heteronuclear NMR Assignments and Secondary Structure of the Coiled Coil Trimerization Domain from Cartilage Matrix Protein in Oxidized and Reduced Forms.	Andrei T Alexandrescu, Jurgen Engel, Marcel JJ Blommers, Richard A Kammerer, Ronald Wiltscheck, Sonja A Dames, Therese Schulthess
1859	Chemical Shifts: 1 set	Reductive cleavage and regeneration of the disulfide bonds in Streptomyces subtilisin inhibitor (SSI) as studied by the carbonyl 13C NMR resonances of cysteinyl residues	Reductive cleavage and regeneration of the disulfide bonds in Streptomyces subtilisin inhibitor (SSI) as studied by the carbonyl 13C NMR resonances of cysteinyl residues	Kenichi Uchida, Masatsune Kainosho, Yoko Miyake
1127	Chemical Shifts: 1 set	Static and Transient Hydrogen-Bonding Interactions in Recombinant Desulfatohirudin Studied by 1H Nuclear Magnetic Resonance Measurements of Amide Proton Exchange Rates and pH-Dependent Chemical Shifts	Static and Transient Hydrogen-Bonding Interactions in Recombinant Desulfatohirudin Studied by 1H Nuclear Magnetic Resonance Measurements of Amide Proton Exchange Rates and pH-Dependent Chemical Shifts	Hideyuki Haruyama, Kurt Wuthrich, Yan-qiu Qian
2712	Chemical Shifts: 1 set	Proton Magnetic Resonance Investigation of the Influence of Quaternary Structure on Iron-Histidine Bonding in Deoxyhemoglobins	Proton Magnetic Resonance Investigation of the Influence of Quaternary Structure on Iron-Histidine Bonding in Deoxyhemoglobins	Gerd N La Mar, H Franklin Bunn, Kiyoshi Nagai, Thomas Jue
2707	Chemical Shifts: 1 set	Proton Magnetic Resonance Investigation of the Influence of Quaternary Structure on Iron-Histidine Bonding in Deoxyhemoglobins	Proton Magnetic Resonance Investigation of the Influence of Quaternary Structure on Iron-Histidine Bonding in Deoxyhemoglobins	Gerd N La Mar, H Franklin Bunn, Kiyoshi Nagai, Thomas Jue
2708	Chemical Shifts: 1 set	Proton Magnetic Resonance Investigation of the Influence of Quaternary Structure on Iron-Histidine Bonding in Deoxyhemoglobins	Proton Magnetic Resonance Investigation of the Influence of Quaternary Structure on Iron-Histidine Bonding in Deoxyhemoglobins	Gerd N La Mar, H Franklin Bunn, Kiyoshi Nagai, Thomas Jue
2709	Chemical Shifts: 1 set	Proton Magnetic Resonance Investigation of the Influence of Quaternary Structure on Iron-Histidine Bonding in Deoxyhemoglobins	Proton Magnetic Resonance Investigation of the Influence of Quaternary Structure on Iron-Histidine Bonding in Deoxyhemoglobins	Gerd N La Mar, H Franklin Bunn, Kiyoshi Nagai, Thomas Jue
2710	Chemical Shifts: 1 set	Proton Magnetic Resonance Investigation of the Influence of Quaternary Structure on Iron-Histidine Bonding in Deoxyhemoglobins	Proton Magnetic Resonance Investigation of the Influence of Quaternary Structure on Iron-Histidine Bonding in Deoxyhemoglobins	Gerd N La Mar, H Franklin Bunn, Kiyoshi Nagai, Thomas Jue
2711	Chemical Shifts: 1 set	Proton Magnetic Resonance Investigation of the Influence of Quaternary Structure on Iron-Histidine Bonding in Deoxyhemoglobins	Proton Magnetic Resonance Investigation of the Influence of Quaternary Structure on Iron-Histidine Bonding in Deoxyhemoglobins	Gerd N La Mar, H Franklin Bunn, Kiyoshi Nagai, Thomas Jue
1413	Chemical Shifts: 1 set	1H NMR Resonance Assignment of the Active Site Residues of Paramagnetic Proteins by 2D Bond Correlation Spectroscopy: Metcyanomyoglobin	1H NMR Resonance Assignment of the Active Site Residues of Paramagnetic Proteins by 2D Bond Correlation Spectroscopy: Metcyanomyoglobin	Gerd N La Mar, Krishnakumar Rajarathnam, Liping P Yu
1475	Chemical Shifts: 1 set	Isotope-Edited NMR of Cyclosporin A Bound to Cyclophilin: Evidence for a Trans 9,10 Amide Bond	Isotope-Edited NMR of Cyclosporin A Bound to Cyclophilin: Evidence for a Trans 9,10 Amide Bond	D A Egan, D H Rich, Jay R Luly, R Helfrich, Robert T Gampe, Rohinton P Edalji, R Simmer, Stephen W Fesik, Thomas F Holzman, V Kishore
644	Chemical Shifts: 1 set	Proline Assignments and Identification of the Cis K116/P117 Peptide Bond in Liganded Staphylococcal Nuclease Using Isotope Edited 2D NMR Spectroscopy	Proline Assignments and Identification of the Cis K116/P117 Peptide Bond in Liganded Staphylococcal Nuclease Using Isotope Edited 2D NMR Spectroscopy	Ad Bax, Dennis A Torchia, Paul E Young, Steven W Sparks
433	Chemical Shifts: 1 set	NMR Study of the Phosphoryl Binding Loop in Purine Nucleotide Proteins: Evidence for a Strong Hydrogen Bonding in Human N-ras p21	NMR Study of the Phosphoryl Binding Loop in Purine Nucleotide Proteins: Evidence for a Strong Hydrogen Bonding in Human N-ras p21	Alfred G Redfield, Mary Z Papastavros
432	Chemical Shifts: 1 set	NMR Study of the Phosphoryl Binding Loop in Purine Nucleotide Proteins: Evidence for a Strong Hydrogen Bonding in Human N-ras p21	NMR Study of the Phosphoryl Binding Loop in Purine Nucleotide Proteins: Evidence for a Strong Hydrogen Bonding in Human N-ras p21	Alfred G Redfield, Mary Z Papastavros
1854	Chemical Shifts: 1 set	Reductive cleavage and regeneration of the disulfide bonds in Streptomyces subtilisin inhibitor (SSI) as studied by the carbonyl 13C NMR resonances of cysteinyl residues	Reductive cleavage and regeneration of the disulfide bonds in Streptomyces subtilisin inhibitor (SSI) as studied by the carbonyl 13C NMR resonances of cysteinyl residues	Kenichi Uchida, Masatsune Kainosho, Yoko Miyake
1855	Chemical Shifts: 1 set	Reductive cleavage and regeneration of the disulfide bonds in Streptomyces subtilisin inhibitor (SSI) as studied by the carbonyl 13C NMR resonances of cysteinyl residues	Reductive cleavage and regeneration of the disulfide bonds in Streptomyces subtilisin inhibitor (SSI) as studied by the carbonyl 13C NMR resonances of cysteinyl residues	Kenichi Uchida, Masatsune Kainosho, Yoko Miyake
1856	Chemical Shifts: 1 set	Reductive cleavage and regeneration of the disulfide bonds in Streptomyces subtilisin inhibitor (SSI) as studied by the carbonyl 13C NMR resonances of cysteinyl residues	Reductive cleavage and regeneration of the disulfide bonds in Streptomyces subtilisin inhibitor (SSI) as studied by the carbonyl 13C NMR resonances of cysteinyl residues	Kenichi Uchida, Masatsune Kainosho, Yoko Miyake
1857	Chemical Shifts: 1 set	Reductive cleavage and regeneration of the disulfide bonds in Streptomyces subtilisin inhibitor (SSI) as studied by the carbonyl 13C NMR resonances of cysteinyl residues	Reductive cleavage and regeneration of the disulfide bonds in Streptomyces subtilisin inhibitor (SSI) as studied by the carbonyl 13C NMR resonances of cysteinyl residues	Kenichi Uchida, Masatsune Kainosho, Yoko Miyake
1858	Chemical Shifts: 1 set	Reductive cleavage and regeneration of the disulfide bonds in Streptomyces subtilisin inhibitor (SSI) as studied by the carbonyl 13C NMR resonances of cysteinyl residues	Reductive cleavage and regeneration of the disulfide bonds in Streptomyces subtilisin inhibitor (SSI) as studied by the carbonyl 13C NMR resonances of cysteinyl residues	Kenichi Uchida, Masatsune Kainosho, Yoko Miyake