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Entry ID	Original Release date	Data summary	Entry Title	Citation Title	Authors
52186	2024-08-28	Chemical Shifts: 1 set	DBC1 52-120	Inhibitory protein-protein interactions of the SIRT1 deacetylase are choreographed by post-translational modification	Andrea Marquez, Angela M Gronenborn, Christopher DeHaven, Gary Thomas, Ian Sipula, Jongsook Kim K Kemper, Lariah Thompson, Laurel Thomas, Mara M Mermigos, Michael Jurczak, Ryan Ponticelli, Troy C Krzysiak, Yong Joon J Kim, You-Jin J Choi, Yunhan Yang
52184	2024-08-28	Chemical Shifts: 1 set	SIRT1 109-233	Inhibitory protein-protein interactions of the SIRT1 deacetylase are choreographed by post-translational modification	Andrea Marquez, Angela M Gronenborn, Christopher DeHaven, Gary Thomas, Ian Sipula, Jongsook Kim K Kemper, Lariah Thompson, Laurel Thomas, Mara M Mermigos, Michael Jurczak, Ryan Ponticelli, Troy C Krzysiak, Yong Joon J Kim, You-Jin J Choi, Yunhan Yang
52181	2024-08-28	Chemical Shifts: 1 set	SIRT1 1-84	Inhibitory protein-protein interactions of the SIRT1 deacetylase are choreographed by post-translational modification	Andrea Marquez, Angela M Gronenborn, Christopher DeHaven, Gary Thomas, Ian Sipula, Jongsook Kim K Kemper, Lariah Thompson, Laurel Thomas, Mara M Mermigos, Michael Jurczak, Ryan Ponticelli, Troy C Krzysiak, Yong Joon J Kim, You-Jin J Choi, Yunhan Yang
52182	2024-08-28	Chemical Shifts: 1 set	SIRT1 1-124	Inhibitory protein-protein interactions of the SIRT1 deacetylase are choreographed by post-translational modification	Andrea Marquez, Angela M Gronenborn, Christopher DeHaven, Gary Thomas, Ian Sipula, Jongsook Kim K Kemper, Lariah Thompson, Laurel Thomas, Mara M Mermigos, Michael Jurczak, Ryan Ponticelli, Troy C Krzysiak, Yong Joon J Kim, You-Jin J Choi, Yunhan Yang
52183	2024-08-28	Chemical Shifts: 1 set	SIRT1 141-233	Inhibitory protein-protein interactions of the SIRT1 deacetylase are choreographed by post-translational modification	Andrea Marquez, Angela M Gronenborn, Christopher DeHaven, Gary Thomas, Ian Sipula, Jongsook Kim K Kemper, Lariah Thompson, Laurel Thomas, Mara M Mermigos, Michael Jurczak, Ryan Ponticelli, Troy C Krzysiak, Yong Joon J Kim, You-Jin J Choi, Yunhan Yang
52178	2024-08-28	Chemical Shifts: 1 set	SIRT1 1-54	Inhibitory protein-protein interactions of the SIRT1 deacetylase are choreographed by post-translational modification	Andrea Marquez, Angela M Gronenborn, Christopher DeHaven, Gary Thomas, Ian Sipula, Jongsook Kim K Kemper, Lariah Thompson, Laurel Thomas, Mara M Mermigos, Michael Jurczak, Ryan Ponticelli, Troy C Krzysiak, Yong Joon J Kim, You-Jin J Choi, Yunhan Yang
31120	2024-05-23	Chemical Shifts: 1 set Spectral_peak_list: 1 set	Solution structure of toxin, U-RDTX-Pp19, from assassin bug Pristhesancus plagipennis	An insect trans-defensin with insecticidal activity from assassin bug venom	A A Walker, C Weirauch, E Gordon, E Wilbrink, G F King, H Wirth, J Jin, M H Goudarzi, S Guo, Y KY Chin
50785	2021-05-18	Chemical Shifts: 1 set	In Vitro Fibrillized 0N3R Tau	Inclusion of the C-Terminal Domain in the beta-Sheet Core of Heparin-Fibrillized Three-Repeat Tau Protein Revealed by Solid-State Nuclear Magnetic Resonance Spectroscopy	Aurelio J Dregni, Haifan Wu, Harrison K Wang, Jia Jin, Mei Hong, Pu Duan, William F DeGrado
28100	2020-11-12	Chemical Shifts: 1 set	Chemical shift assignment for human EDC3 residues 104-197	EDC3 phosphorylation regulates growth and invasion through controlling P-body formation and dynamics	Andrew Dl D Nelson, Andrew S Kraft, Anne E Cress, Ghassan Mouneimne, Jaime Mc M Gard, Jeremiah J Bearss, Jin H Song, J Ross R Buchan, Koichi Okumura, Marina Cardo-Vila, Matthew R Harter, Neha Singh, Nikita Fernandes, Sathish Kr K Padi, Wolfgang Peti, Yang Li
30647	2020-01-17	Chemical Shifts: 1 set	Dg12a	Weaponisation 'on the fly': Convergent recruitment of knottin and defensin peptide scaffolds into the venom of predatory assassin flies	Agota Csoti, Akello J Agwa, Andrew A Walker, Christina I Schroeder, Glenn F King, Gyorgy Panyi, Jiayi Jin, Tibor G Szanto
30648	2020-01-17	Chemical Shifts: 1 set	Dg3b	Weaponisation 'on the fly': Convergent recruitment of knottin and defensin peptide scaffolds into the venom of predatory assassin flies	Agota Csoti, Akello J Agwa, Andrew A Walker, Christina I Schroeder, Glenn F King, Gyorgy Panyi, Jiayi Jin, Tibor G Szanto
30626	2019-08-09	Chemical Shifts: 1 set	Solution structure of conotoxin MiXXVIIA	Conotoxin phi-MiXXVIIA from the Superfamily G2 Employs a Novel Cysteine Framework that Mimics Granulin and Displays Anti-Apoptotic Activity.	A H Jin, A Loukas, D Wilson, I Vetter, M J Smout, N L Daly, P F Alewood, R J Lewis, S Dutertre, Z Dekan
27628	2018-11-02	Chemical Shifts: 1 set	Backbone 1H, 13C, and 15N Chemical Shift Assignments for SIRT1 183-233	An Insulin-Responsive Sensor in the SIRT1 Disordered Region Binds DBC1 and PACS-2 to Control Enzyme Activity.	Angela M Gronenborn, Daniel L Marks, Gary Thomas, Laura L Thomas, Laurel Thomas, Leonardus Koharudin, Panayiotis V Benos, Shan Luan, Stephanie M Krasnow, Sylvain Auclair, Troy C Krzysiak, Yiqi Qian, You-Jin J Choi
30406	2018-03-05	Chemical Shifts: 1 set Spectral_peak_list: 2 sets	Solution NMR Structure of Conotoxin G117 from Conus geographus	Chemical Synthesis and NMR Solution Structure of Conotoxin GXIA from Conus geographus	Ai-Hua H Jin, David A Armstrong, K Johan J Rosengren, Nayara Braga Emidio, Paul F Alewood, Richard J Lewis
27233	2021-07-22	Chemical Shifts: 1 set	Backbone 1H, 13C, and 15N Chemical Shift Assignments for MazF from M. tuberculosis	Structural analyses of the MazEF4 toxin-antitoxin pair in Mycobacterium tuberculosis provide evidence for a unique extracellular death factor	Bong-Jin J Lee, Do-Hwan H Ahn, Hye-Jin J Yoon, Ki-Young Y Lee, Sang Jae J Lee, Soon-Jong J Kim, Sung Jean J Park
27232	2017-08-28	Chemical Shifts: 1 set	13C chemical shifts of solid-state NMR signals of subunit c-ring of TFoF1 ATP synthase	Direct assignment of 13C solid-state NMR signals of TFoF1 ATP synthase subunit c-ring in lipid membranes and its implication for the ring structure	Hideo Akutsu, Masasuke Yoshida, Su-Jin J Kang, Suyeon Bak, Toshiharu Suzuki, Toshimichi Fujiwara, Yasuto Todokoro
27175	2018-08-22	Chemical Shifts: 1 set	1H, 15N, 13C backbone resonance assignments of the D10N variant of beta-phosphoglucomutase in a MgII-free complex with beta-glucose 1,6-bisphosphate	van der Waals Contact between Nucleophile and Transferring Phosphorus Is Insufficient To Achieve Enzyme Transition-State Architecture	Andrea M Hounslow, Angus J Robertson, Clare R Trevitt, Claudine Bisson, Jonathan P Waltho, Luke A Johnson, Matthew J Cliff, Matthew W Bowler, Michael G Blackburn, Nicola J Baxter, Yi Jin
27174	2018-08-22	Chemical Shifts: 1 set	1H, 15N, 13C backbone resonance assignments of the D10N variant of beta-phosphoglucomutase in a MgII-bound complex with beta-glucose 1,6-bisphosphate	van der Waals Contact between Nucleophile and Transferring Phosphorus Is Insufficient To Achieve Enzyme Transition-State Architecture	Andrea M Hounslow, Angus J Robertson, Clare R Trevitt, Claudine Bisson, G Michael Blackburn, Jonathan P Waltho, Luke A Johnson, Matthew J Cliff, Matthew W Bowler, Nicola J Baxter, Yi Jin
36045	2018-07-10	Chemical Shifts: 1 set	Solution structure of E.coli HdeA	Characterizations of the Interactions between Escherichia coli Periplasmic Chaperone HdeA and Its Native Substrates during Acid Stress	C Jin, C Yang, J Ding, X C Yu, X Niu, Y Hu
26961	2017-02-15	Chemical Shifts: 1 set	Backbone 1H, 13C, and 15N Chemical Shift Assignments for SUSP4(201-300)	The Mechanism of p53 Rescue by SUSP4	Chewook Lee, Do-Hyoung H Kim, Eun-Ji J Cha, Ji-Eun E Lim, Joan J Han, Kyou-Hoon H Han, Kyung-Tae T Kim, Seung-Hee H Hong, Si-Hyung H Lee, Ye-Jin J Cho
25986	2017-02-16	Chemical Shifts: 1 set	Solution structure of the F87M/L110M variant of transthyretin in the monomeric state	Mechanistic basis for the recognition of a misfolded protein by the molecular chaperone Hsp90	Bliss J Chang, Javier Oroz, Jin Hae H Kim, Markus Zweckstetter
25151	2015-08-17	Chemical Shifts: 1 set	Solution structure of spider-venom peptide Hs1a	Nav1.7 inhibitors normalise mechanical responses in chronic visceral hypersensitivity	Alan Wickenden, Fernanda Cardoso, Frank Bosmans, Glenn F King, Irina Vetter, Joel Castro, Johnny X Huang, Joseph A Nicolazzo, Julie K Klint, Lian Jin, Matt A Cooper, Mehdi Mobli, Natali Minassian, Rebecca Hagan, Richard J Lewis, Robert Neff, Sing Y Er, Stuart M Brierley, Yi Liu
19979	2014-12-22	Chemical Shifts: 1 set	Solution structure of B24G insulin	Protective hinge in insulin opens to enable its receptor engagement	Brian J Smith, Charles T Roberts, Colin W Ward, Donald F Steiner, Faramarz Ismail-Beigi, John G Menting, Jonathan Whittaker, Julie M Carroll, Linda J Whittaker, Michael A Weiss, Michael C Lawrence, Nalinda P Wickramasinghe, Natalie Strokes, Nelson B Phillips, Satya P Yadav, Shu Jin Chan, Vijay Pandyarajan, Virander S Chauhan, Wieslawa Milewski, Yanwu Yang, Zhu-li Wan
19354	2014-02-13	Chemical Shifts: 1 set	Solution structure of Smoothened	Structural insights into the role of the Smoothened cysteine-rich domain in Hedgehog signalling.	Candace E Carroll, Christy RR Grace, Cristina D Guibao, Ho-Jin Lee, Jie J Zheng, Ju Bao, Rajashree Rana, Stacey K Ogden, Suresh Marada
19091	2014-12-18	Chemical Shifts: 1 set	Backbone 1H, 15N Chemical Shift Assignments for wild-type Escherichia coli Adenylate Kinase with 20mM ADP and Magnesium at 298K	Catalytic Strategies used by Kinases in Phosphoryl-Transfer Reactions	Dimitr V Pachov, Dorothee Kern, Francesco Pontiggia, Lien A Phung, Michael F Hagan, Padraig N Murphy, Renee Otten, Roman V Agafonov, S Jordan J Kerns, Vu Thai, Young-Jin Cho
19093	2014-12-18	Chemical Shifts: 1 set	Backbone 1H, 15N Chemical Shift Assignments for R156K mutant Escherichia coli Adenylate Kinase with 20mM ADP and magnesium at 293K	Catalytic Strategies used by Kinases in Phosphoryl-Transfer Reactions	Dimitr V Pachov, Dorothee Kern, Francesco Pontiggia, Lien A Phung, Michael F Hagan, Padraig N Murphy, Renee Otten, Roman V Agafonov, S Jordan J Kerns, Vu Thai, Young-Jin Cho
19092	2014-12-18	Chemical Shifts: 1 set	Backbone 1H, 15N Chemical Shift Assignments for R156K mutant Escherichia coli Adenylate Kinase with 20mM ADP at 293K	Catalytic Strategies used by Kinases in Phosphoryl-Transfer Reactions	Dimitr V Pachov, Dorothee Kern, Francesco Pontiggia, Lien A Phung, Michael F Hagan, Padraig N Murphy, Renee Otten, Roman V Agafonov, S Jordan J Kerns, Vu Thai, Young-Jin Cho
19089	2014-12-18	Chemical Shifts: 4 sets	Backbone 1H, 15N Chemical Shift Assignments for wild-type Escherichia coli Adenylate Kinase with 20mM ADP at 293, 298, 303, and 313K	Catalytic Strategies used by Kinases in Phosphoryl-Transfer Reactions	Dimitr V Pachov, Dorothee Kern, Francesco Pontiggia, Lien A Phung, Michael F Hagan, Padraig N Murphy, Renee Otten, Roman V Agafonov, S Jordan J Kerns, Vu Thai, Young-Jin Cho
19090	2014-12-18	Chemical Shifts: 1 set	Backbone 1H, 15N Chemical Shift Assignments for wild-type Escherichia coli Adenylate Kinase with 20mM ADP and Calcium at 298K	Catalytic Strategies used by Kinases in Phosphoryl-Transfer Reactions	Dimitr V Pachov, Dorothee Kern, Francesco Pontiggia, Lien A Phung, Michael F Hagan, Padraig N Murphy, Renee Otten, Roman V Agafonov, S Jordan J Kerns, Vu Thai, Young-Jin Cho
18783	2013-10-21	Chemical Shifts: 1 set	SOLUTION NMR STRUCTURE OF ASTEROPSIN B FROM A MARINE SPONGE ASTEROPUS SP.	Asteropsins B-D, sponge-derived knottins with potential utility as a novel scaffold for oral peptide drugs.	Bong-Jin Lee, Huayue Li, Jee H Jung, John J Bowling, Jongki Hong, Mark T Hamann, Mingzhi Su
18381	2012-09-14	Chemical Shifts: 1 set	The backbone chemical shifts of IscU complexed with HscA	Specialized Hsp70 Chaperone (HscA) Binds Preferentially to the Disordered Form, whereas J-protein (HscB) Binds Preferentially to the Structured Form of the Iron-Sulfur Cluster Scaffold Protein (IscU).	Darius C-F Chow, Jin Hae Kim, John L Markley, Marco Tonelli, Ronnie O Frederick
6430	2009-07-06	Chemical Shifts: 1 set	1H and 31P chemical shift assignments for HIV-1 integrase inhibitor 93del	An interlocked dimeric parallel-stranded DNA quadruplex: a potent inhibitor of HIV-1 integrase	Anh Tuan Phan, Aurelie Faure, Dinshaw J Patel, Jin-Biao Ma, Marie-Line Andreola, Vitaly Kuryavyi
5826	2004-04-06	Chemical Shifts: 1 set	Nickel-binding property of Bacillus pasteurii UreE and the role of the C-terminal tail	Structural characterization of the nickel-binding properties of bacillus pasteurii UreE in solution	Bong-Jin Lee, Hyung-Sik Won, I S Shin, J H Kim, M H Lee, Yeon-Hee Lee