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Entry ID	Original Release date	Data summary	Entry Title	Citation Title	Authors
51352	2023-07-04	Chemical Shifts: 1 set	1H,13C,15N backbone assignment of the human interleukin-1 receptor antagonist C66A/C122A	Robust automated backbone triple resonance NMR assignments of proteins using Bayesian-based simulated annealing	A Joshua J Wand, Anthony C Bishop, Glorise Torres-Montalvo, Kyle Mimun, Sravya Kotaru
51347	2023-07-04	Chemical Shifts: 1 set	Backbone assignments for Indole-3-glycerol phosphate synthase hyper-thermophilic homolog from Sulfolobus solfataricus R43S mutant (SsIGPS.R43S)	Robust automated backbone triple resonance NMR assignments of proteins using Bayesian-based simulated annealing	A Joshua J Wand, Anthony C Bishop, Glorise Torres-Montalvo, Kyle Mimun, Sravya Kotaru
27465	2020-04-07	Order Parameters: 1 set	Sensory rhodopsin II has distinct fast internal motion and residual conformational entropy	Membrane Proteins Have Distinct Fast Internal Motion and Residual Conformational Entropy	A Joshua J Wand, Brian Fuglestad, Bryan S Marques, Danny W Lin, Evan S O'Brien, Henry J Lessen, Karen G Fleming, Kushol Gupta, Matthew A Stetz
27273	2018-05-22	Chemical Shifts: 1 set	Backbone 1H, 13C, and 15N Chemical Shift Assignments of phosphorylated (T183 and Y185) p38 alpha	Dynamic activation and regulation of the mitogen-activated protein kinase p38	A Joshua J Wand, Daniele Granata, Ganesan Senthil S Kumar, Kresten Lindorff-Larsen, Michael W Clarkson, Micha Kunze, Rebecca Page, Wolfgang Peti
27274	2018-05-22	Chemical Shifts: 1 set	Backbone 1H, 13C, and 15N Chemical Shift Assignments of phosphorylated (T183 and Y185) p38 alpha in complex with an MKK3bKIM peptide	Dynamic activation and regulation of the mitogen-activated protein kinase p38	A Joshua J Wand, Daniele Granata, Ganesan Senthil S Kumar, Kresten Lindorff-Larsen, Michael W Clarkson, Micha Kunze, Rebecca Page, Wolfgang Peti
26983	2017-06-27	Chemical Shifts: 2 sets Order Parameters: 2 sets	HBP(D24R)-Histamine-Seratonin methyl and amide order parameters	Entropy in molecular recognition by proteins	A Joshua J Wand, Jackwee Lim, Jeffrey Granja, Jose A Caro, Kathleen G Valentine, Kim A Sharp, Kyle W Harpole, Vignesh Kasinath
26670	2017-06-27	Order Parameters: 3 sets	order parameters for the CaM(E84K):nNOS(p) complex	Entropy in molecular recognition by proteins	A Joshua J Wand, Jackwee Lim, Jeffrey Granja, Jose A Caro, Kathleen G Valentine, Kim A Sharp, Kyle W Harpole, Vignesh Kasinath
26667	2017-06-27	Order Parameters: 2 sets	Backbone and side chain order parameters for calcium-bound calmodulin (E84K)	Entropy in molecular recognition by proteins	A Joshua J Wand, Jackwee Lim, Jeffrey Granja, Jose A Caro, Kathleen G Valentine, Kim A Sharp, Kyle W Harpole, Vignesh Kasinath
26620	2017-06-27	Chemical Shifts: 1 set Order Parameters: 1 set	Amide/Methyl/Aromatic chemical shift and order parameter of Barnase-dCGAC	Entropy in molecular recognition by proteins	A Joshua J Wand, Jackwee Lim, Jeffrey Granja, Jose A Caro, Kathleen G Valentine, Kim A Sharp, Kyle W Harpole, Vignesh Kasinath
26619	2017-06-27	Chemical Shifts: 1 set Order Parameters: 1 set	Amide/Methyl/Aromatic Chemical Shifts and Order Parameters of Free Barnase	Entropy in molecular recognition by proteins	A Joshua J Wand, Jackwee Lim, Jeffrey Granja, Jose A Caro, Kathleen G Valentine, Kim A Sharp, Kyle W Harpole, Vignesh Kasinath
25728	2017-06-27	Chemical Shifts: 1 set Order Parameters: 2 sets	1H, 13C, and 15N Chemical Shift Assignments for Histamine-Binding Protein (D24R) apo	Entropy in molecular recognition by proteins	A Joshua J Wand, Jackwee Lim, Jeffrey Granja, Jose A Caro, Kathleen G Valentine, Kim A Sharp, Kyle W Harpole, Vignesh Kasinath
25727	2017-06-27	Chemical Shifts: 1 set Order Parameters: 2 sets	1H, 13C, and 15N Chemical Shift Assignments for Histamine-Binding Protein (D24R) bound to histamine	Entropy in molecular recognition by proteins	A Joshua J Wand, Jackwee Lim, Jeffrey Granja, Jose A Caro, Kathleen G Valentine, Kim A Sharp, Kyle W Harpole, Vignesh Kasinath
25640	2015-10-26	Chemical Shifts: 1 set	STRUCTURE OF OXIDIZED HORSE HEART CYTOCHROME C ENCAPSULATED IN REVERSE MICELLES	Defining the Apoptotic Trigger: THE INTERACTION OF CYTOCHROME c AND CARDIOLIPIN	A Joshua Wand, Brian Fuglestad, Cecilia Tommos, Evan S O'Brien, Nathaniel V Nucci
26503	2015-01-23	T1 Relaxation Values: 6 sets T1rho Relaxation Values: 6 sets Order Parameters: 3 sets	A 13C Labeling Strategy Reveals a Range of Aromatic Side Chain Motion in Calmodulin	A 13C Labeling Strategy Reveals a Range of Aromatic Side Chain Motion in Calmodulin	Joshua A Wand, Kathleen G Valentine, Vignesh Kasinath
18305	2012-06-13	Order Parameters: 2 sets	Order parameters for HEWL-chitotriose	The dynamical response of hen egg white lysozyme to the binding of a carbohydrate ligand.	A Joshua Wand, Kathleen G Valentine, Veronica R Moorman
18304	2012-06-13	Order Parameters: 2 sets	Order parameters for HEWL	The dynamical response of hen egg white lysozyme to the binding of a carbohydrate ligand.	A Joshua Wand, Kathleen G Valentine, Veronica R Moorman
18252	2019-09-03	Chemical Shifts: 1 set Order Parameters: 2 sets	Cdc42Hs-GMPPCP-PBD46 Complex	Dynamic and thermodynamic response of the Ras protein Cdc42Hs upon association with the effector domain of PAK3	A Joshua J Wand, Fiona M Love, Jakob Dogan, Kathleen G Valentine, Sabrina Bedard, Veronica R Moorman, Vignesh Kasinath
18251	2019-09-03	Chemical Shifts: 1 set Order Parameters: 2 sets	Cdc42Hs-GMPPCP Complex	Dynamic and thermodynamic response of the Ras protein Cdc42Hs upon association with the effector domain of PAK3	A Joshua J Wand, Fiona M Love, Jakob Dogan, Kathleen G Valentine, Sabrina Bedard, Veronica R Moorman, Vignesh Kasinath
18116	2019-08-29	Order Parameters: 12 sets	backbone and sidechain order parameters for ubiquitin at 1, 400, 800, 1200, 1600 and 2500 bar	Coupled motion in proteins revealed by pressure perturbation	A Joshua J Wand, Nathaniel V Nucci, Veronica R Moorman, Vignesh Kasinath, Vincent J Hilser, Yinan Fu
17711	2012-06-05	Chemical Shifts: 1 set	Solution structure of the core SMN-Gemin2 complex	Solution structure of the core SMN-Gemin2 complex.	A Joshua Wand, Cecilia Tommos, Gregory D Van Duyne, John M Gledhill Jr, Kathleen G Valentine, Kathryn L Sarachan, Kushol Gupta, Matthew Bernens, Veronica R Moorman
16771	2011-05-19	Chemical Shifts: 1 set	Integrin beta3 subunit in a disulfide linked alphaIIb-beta3 cytosolic domain	NMR analysis of the alphaIIb beta3 cytoplasmic interaction suggests a mechanism for integrin regulation.	A Joshua Wand, David T Moore, Douglas G Metcalf, Joel S Bennett, Joseph M Kielec, Kathleen G Valentine, Kathleen Molnar, William F DeGrado, Yibing Wu
15185	2007-10-05	Order Parameters: 2 sets	backbone and side chain methly order parameters and correlation times for calmodulin in complex with the eNOS peptide	Conformational entropy in molecular recognition by proteins	Joshua Wand, Kathleen G Valentine, Kendra K Frederick, Michael S Marlow
15186	2007-10-05	Order Parameters: 2 sets	backbone and side chain methly order parameters and correlation times for calmodulin in complex with the smMLCK peptide	Conformational entropy in molecular recognition by proteins	Joshua Wand, Kathleen G Valentine, Kendra K Frederick, Michael S Marlow
15187	2007-10-05	Order Parameters: 2 sets	Backbone and side-chain methyl order parameters and effective correlation times for calmodulin in complex with Phosphodiesterase1A peptide	Conformational entropy in molecular recognition by proteins	A Joshua Wand, Kathy G Valentine, Kendra K Frederick, Michael S Marlow
15188	2007-10-05	Order Parameters: 2 sets	backbone and side chain methly order parameters and correlation times for calcium-saturated calmodulin	Conformational entropy in molecular recognition by proteins	Joshua Wand, Kathleen G Valentine, Kendra K Frederick, Michael S Marlow
15184	2007-10-05	Order Parameters: 2 sets	backbone and side chain methly order parameters and correlation times for calmodulin in complex with the eNOS peptide	Conformational entropy in molecular recognition by proteins	Joshua Wand, Kathleen G Valentine, Kendra K Frederick, Michael S Marlow
15183	2007-10-05	Order Parameters: 2 sets	Backbone and side-chain methyl order parameters and effective correlation times for calmodulin in complex with CaMKKalpha peptide	Conformational entropy in molecular recognition by proteins	A Joshua Wand, Kathy G Valentine, Kendra K Frederick, Michael S Marlow
7247	2008-08-13	Chemical Shifts: 1 set Coupling Constants: 1 set	Solution structure of a single chain diiron protein model	Solution NMR Structure of a Designed Metalloprotein and Complementary Molecular Dynamics Refinement	A Joshua Wand, Jennifer R Calhoun, Kathleen G Valentine, Katrin Spiegel, Matteo Dal Peraro, Michael L Klein, Weixia Liu, William F DeGrado
7015	2013-02-15	Chemical Shifts: 1 set	NMR assignments for apo- and Ca2+ saturated paramecium calmodulin	Calcium-induced conformational switching of Paramecium calmodulin provides evidence for domain coupling.	A Joshua Wand, Brenda R Sorensen, James K Kranz, Madeline A Shea, Olav R Jaren
6707	2013-02-15	Chemical Shifts: 1 set	NMR assignments for apo- and Ca2+ saturated paramecium calmodulin	Calcium-induced conformational switching of Paramecium calmodulin provides evidence for domain coupling.	A Joshua Wand, Brenda R Sorensen, James K Kranz, Madeline A Shea, Olav R Jaren
6466	2011-08-11	Chemical Shifts: 1 set Heteronuclear NOE Values: 1 set T1 Relaxation Values: 1 set Order Parameters: 1 set	Internal Dynamics of Human Ubiquitin Revealed by 13C-Relaxation Studies of Randomly Fractionally Labeled Protein	Internal Dynamics of Human Ubiquitin Revealed by 13C-Relaxation Studies of Randomly Fractionally Labeled Protein	A Joshua Wand, Jeffrey L Urbauer, Ramona J Bieber, Robert P McEvoy
5829	2003-09-28	Chemical Shifts: 1 set	Backbone and sidechain heteronuclear resonance assignments and hyperfine nuclear magnetic resonance shifts in horse cytochrome c	Backbone and Side-chain Heteronuclear Resonance Assignments and Hyperfine NMR Shifts in Horse Cytochrome c	A Joshua Wand, Jon Rumbley, S Walter Englander, Weixia Liu
5830	2003-09-28	Chemical Shifts: 1 set	Backbone and sidechain heteronuclear resonance assignments and hyperfine nuclear magnetic resonance shifts in horse cytochrome c	Backbone and Side-chain Heteronuclear Resonance Assignments and Hyperfine NMR Shifts in Horse Cytochrome c	A Joshua Wand, Jon Rumbley, S Walter Englander, Weixia Liu
5827	2003-09-28	Chemical Shifts: 1 set	Backbone and sidechain heteronuclear resonance assignments and hyperfine nuclear magnetic resonance shifts in horse cytochrome c	Backbone and Side-chain Heteronuclear Resonance Assignments and Hyperfine NMR Shifts in Horse Cytochrome c	A Joshua Wand, Jon Rumbley, S Walter Englander, Weixia Liu
5828	2003-09-28	Chemical Shifts: 1 set	Backbone and sidechain heteronuclear resonance assignments and hyperfine nuclear magnetic resonance shifts in horse cytochrome c	Backbone and Side-chain Heteronuclear Resonance Assignments and Hyperfine NMR Shifts in Horse Cytochrome c	A Joshua Wand, Jon Rumbley, S Walter Englander, Weixia Liu
5387	2003-06-12	Chemical Shifts: 1 set	Complete 1H, 13C, and 15N chemical shifts for human recombinant ubiquitin in reverse micelles	Validation of protein structure from preparations of encapsulated proteins dissolved in low viscosity fluids	A Joshua Wand, Charles R Babu, Peter F Flynn
5356	2003-01-06	Chemical Shifts: 1 set	Backbone and sidechain chemical shift assignments for GS-a3W protein	Structure of a De Novo Designed Protein Model of Radical Enzymes	A Joshua Wand, Cecilia Tommos, Ernesto J Fuentes, P Leslie Dutton, Qing-Hong Dai
5286	2002-06-13	Chemical Shifts: 1 set	Backbone 1H, 13C, and 15N Chemical shift assigments for [13C,15N]CaM:CaMKIp complex	A Direct Test of the Reductionist Approach to Structural Studies of Calmodulin Activity: Relevance of Peptide Models of Target Proteins	A Joshua Wand, Angus C Nairn, Eun K Lee, James K Kranz
5287	2002-06-13	Chemical Shifts: 1 set	Backbone 1H and 15N Chemical shift assigments for [2H,15N]CaM:CaMKI(320) complex	A Direct Test of the Reductionist Approach to Structural Studies of Calmodulin Activity: Relevance of Peptide Models of Target Proteins	A Joshua Wand, Angus C Nairn, Eun K Lee, James K Kranz
5227	2002-06-13	Chemical Shifts: 1 set	Dissection of the Pathway of Molecular Recognition by Calmodulin	Dissection of the Pathway of Molecular Recognition by Calmodulin	A Joshua Wand, Ernesto J Fuentes, James K Kranz, Peter F Flynn
4065	2002-08-12	Chemical Shifts: 2 sets	Sequence-Specific Resonance Assignments for a Designed Four-Alpha-Helix-Bundle Protein	Sequence-Specific Resonance Assignments for a Designed Four-Alpha-Helix-Bundle Protein	Brian R Gibney, Francesc Rabanal, Jack J Skalicky, Joshua A Wand, Leslie P Dutton, Ramona J Bieber
392	1995-07-31	Chemical Shifts: 1 set	Structural Characterization of the Interactions between Calmodulin and Skeletal Muscle Myosin Light Chain Kinase: Effect of Peptide (576-594)G Binding on the Ca2+-Binding Domains	Structural Characterization of the Interactions between Calmodulin and Skeletal Muscle Myosin Light Chain Kinase: Effect of Peptide (576-594)G Binding on the Ca2+-Binding Domains	A Joshua Wand, Steven H Seeholzer
391	1995-07-31	Chemical Shifts: 1 set	Structural Characterization of the Interactions between Calmodulin and Skeletal Muscle Myosin Light Chain Kinase: Effect of Peptide (576-594)G Binding on the Ca2+-Binding Domains	Structural Characterization of the Interactions between Calmodulin and Skeletal Muscle Myosin Light Chain Kinase: Effect of Peptide (576-594)G Binding on the Ca2+-Binding Domains	A Joshua Wand, Steven H Seeholzer
274	1995-07-31	Chemical Shifts: 1 set	Proton Resonance Assignments of Horse Ferricytochrome c	Proton Resonance Assignments of Horse Ferricytochrome c	A Joshua Wand, Deena L Di Stefano, Heinrich Roder, S Walter Englander, Yiqing Feng
2574	1995-07-31	Chemical Shifts: 1 set	Fast Internal Main-Chain Dynamics of Human Ubiquitin	Fast Internal Main-Chain Dynamics of Human Ubiquitin	A Joshua Wand, Diane M Schneider, Martin J Dellwo
2573	1995-07-31	Chemical Shifts: 1 set	Fast Internal Main-Chain Dynamics of Human Ubiquitin	Fast Internal Main-Chain Dynamics of Human Ubiquitin	A Joshua Wand, Diane M Schneider, Martin J Dellwo
244	1995-07-31	Chemical Shifts: 1 set	Two-Dimensional 1H NMR Studies of Cytochrome c: Assignment of the N-Terminal Helix	Two-Dimensional 1H NMR Studies of Cytochrome c: Assignment of the N-Terminal Helix	A Joshua Wand, S Walter Englander
243	1995-07-31	Chemical Shifts: 1 set	Two-Dimensional 1H NMR Studies of Cytochrome c: Assignment of the N-Terminal Helix	Two-Dimensional 1H NMR Studies of Cytochrome c: Assignment of the N-Terminal Helix	A Joshua Wand, S Walter Englander
1672	1995-07-31	Chemical Shifts: 1 set	1H and 15N NMR Resonance Assignments and Preliminary Structural Characterization of Escherichia coli Apocytochrome b562	1H and 15N NMR Resonance Assignments and Preliminary Structural Characterization of Escherichia coli Apocytochrome b562	A Joshua Wand, Stephen G Sligar, Yiqing Feng
915	1995-07-31	Chemical Shifts: 1 set	Assignment of the Backbone 1H and 15N NMR Resonances of Bacteriophage T4 Lysozyme	Assignment of the Backbone 1H and 15N NMR Resonances of Bacteriophage T4 Lysozyme	A Joshua Wand, Alfred G Redfield, David F Lowry, Frederick W Dahlquist, Lawrence P McIntosh