Biological Magnetic Resonance Data BankA Repository for Data from NMR Spectroscopy on Proteins, Peptides, Nucleic Acids, and other Biomolecules |
Member of |
Entry ID | Data summary | Entry Title | Citation Title | Authors |
---|---|---|---|---|
30844 | Chemical Shifts: 1 set |
High resolution NMR solution structure of a de novo designed minimal thioredoxin fold protein | Sampling of structure and sequence space of small protein folds | A Tobin, D Baker, E M Strauch, J L Urbauer, K Noble, L Carter, R Crow, T Linsky |
30753 | Chemical Shifts: 1 set |
Solution NMR structure of de novo designed TMB2.3 | De novo design of transmembrane beta-barrels | Alex Kang, Alyssa Q Stiving, Anastassia A Vorobieva, Asim K Bera, Binyong Liang, Cameron M Chow, Dagan C Marx, David Baker, David J Brockwell, G Nasir N Khan, Jim E Horne, Karen G Fleming, Lukas K Tamm, Paul White, Sheena E Radford, Sinduja Marx, Sophie R Harvey, Stacey Gerben, Vicki H Wysocki |
30574 | Chemical Shifts: 1 set |
NMR ensemble of computationally designed protein XAA | Computational design of closely related proteins that adopt two well-defined but structurally divergent folds | A C McShan, D A Fletcher, D Baker, D Moschidi, K Y Wei, L P Carter, M J Bick, N G Sgourakis, P S Huang, S E Boyken, S Nerli |
30573 | Chemical Shifts: 1 set |
NMR ensemble of computationally designed protein XAA_GVDQ mutant M4L | Computational design of closely related proteins that adopt two well-defined but structurally divergent folds | A C McShan, D A Fletcher, D Baker, D Moschidi, K Y Wei, L P Carter, M J Bick, N G Sgourakis, P S Huang, S E Boyken, S Nerli |
34295 | Chemical Shifts: 1 set |
Stabilising and Understanding a Miniprotein by Rational Design. | Stabilizing and Understanding a Miniprotein by Rational Redesign. | C Williams, D Nicol, D N Woolfson, E G Baker, F Zieleniewski, J Samphire, K L Porter Goff, M P Crump |
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 |
30450 | Chemical Shifts: 1 set |
CS-rosetta determined structures of the N-terminal domain of AlgF from P. aeruginosa | Pseudomonas aeruginosa AlgF is an adaptor protein required for acetylation of the alginate exopolysaccharide | E H Snell, E N Kitova, G B Whitfield, J DC Codee, J S Klassen, J T Weadge, K E Low, L M Riley, M TC Walvoort, P A Chong, P Baker, P L Howell, S D Tammam, S J Caldwell, T D Grant |
30360 | Chemical Shifts: 1 set |
Solution structure of de novo macrocycle design10.2 | Comprehensive computational design of ordered peptide macrocycles. | D A Silva, D Baker, D E Kim, F Pardo-Avila, G Bhardwaj, G Varani, I K Webb, J N Adkins, J R Cort, M D Shortridge, P Hosseinzadeh, S A Rettie, T W Craven, V K Mulligan, Y M Ibrahim |
30359 | Chemical Shifts: 1 set |
Solution structure of de novo macrocycle design10.1 | Comprehensive computational design of ordered peptide macrocycles. | D A Silva, D Baker, D E Kim, F Pardo-Avila, G Bhardwaj, G Varani, I K Webb, J N Adkins, J R Cort, M D Shortridge, P Hosseinzadeh, S A Rettie, T W Craven, V K Mulligan, Y M Ibrahim |
30357 | Chemical Shifts: 1 set |
Solution structure of de novo macrocycle design8.2 | Comprehensive computational design of ordered peptide macrocycles. | D A Silva, D Baker, D E Kim, F Pardo-Avila, G Bhardwaj, G Varani, I K Webb, J N Adkins, J R Cort, M D Shortridge, P Hosseinzadeh, S A Rettie, T W Craven, V K Mulligan, Y M Ibrahim |
30358 | Chemical Shifts: 1 set |
Solution structure of de novo macrocycle design9.1 | Comprehensive computational design of ordered peptide macrocycles. | D A Silva, D Baker, D E Kim, F Pardo-Avila, G Bhardwaj, G Varani, I K Webb, J N Adkins, J R Cort, M D Shortridge, P Hosseinzadeh, S A Rettie, T W Craven, V K Mulligan, Y M Ibrahim |
30366 | Chemical Shifts: 1 set |
Solution structure of de novo macrocycle design7.3a | Comprehensive computational design of ordered peptide macrocycles. | D A Silva, D Baker, D E Kim, F Pardo-Avila, G Bhardwaj, G Varani, I K Webb, J N Adkins, J R Cort, M D Shortridge, P Hosseinzadeh, S A Rettie, T W Craven, V K Mulligan, Y M Ibrahim |
30365 | Chemical Shifts: 1 set |
Solution structure of de novo macrocycle design7.3a | Comprehensive computational design of ordered peptide macrocycles. | D A Silva, D Baker, D E Kim, F Pardo-Avila, G Bhardwaj, G Varani, I K Webb, J N Adkins, J R Cort, M D Shortridge, P Hosseinzadeh, S A Rettie, T W Craven, V K Mulligan, Y M Ibrahim |
30364 | Chemical Shifts: 1 set |
Solution structure of de novo macrocycle design7.2 | Comprehensive computational design of ordered peptide macrocycles. | D A Silva, D Baker, D E Kim, F Pardo-Avila, G Bhardwaj, G Varani, I K Webb, J N Adkins, J R Cort, M D Shortridge, P Hosseinzadeh, S A Rettie, T W Craven, V K Mulligan, Y M Ibrahim |
30363 | Chemical Shifts: 1 set |
Solution structure of de novo macrocycle design14_ss | Comprehensive computational design of ordered peptide macrocycles. | D A Silva, D Baker, D E Kim, F Pardo-Avila, G Bhardwaj, G Varani, I K Webb, J N Adkins, J R Cort, M D Shortridge, P Hosseinzadeh, S A Rettie, T W Craven, V K Mulligan, Y M Ibrahim |
30362 | Chemical Shifts: 1 set |
Solution structure of de novo macrocycle design12_ss | Comprehensive computational design of ordered peptide macrocycles. | D A Silva, D Baker, D E Kim, F Pardo-Avila, G Bhardwaj, G Varani, I K Webb, J N Adkins, J R Cort, M D Shortridge, P Hosseinzadeh, S A Rettie, T W Craven, V K Mulligan, Y M Ibrahim |
30361 | Chemical Shifts: 1 set |
Solution structure of de novo macrocycle design11_ss | Comprehensive computational design of ordered peptide macrocycles. | D A Silva, D Baker, D E Kim, F Pardo-Avila, G Bhardwaj, G Varani, I K Webb, J N Adkins, J R Cort, M D Shortridge, P Hosseinzadeh, S A Rettie, T W Craven, V K Mulligan, Y M Ibrahim |
30355 | Chemical Shifts: 1 set |
Solution structure of de novo macrocycle Design8.1 | Comprehensive computational design of ordered peptide macrocycles. | D A Silva, D Baker, D E Kim, F Pardo-Avila, G Bhardwaj, G Varani, I K Webb, J N Adkins, J R Cort, M D Shortridge, P Hosseinzadeh, S A Rettie, T W Craven, V K Mulligan, Y M Ibrahim |
30356 | Chemical Shifts: 1 set |
Solution structure of de novo macrocycle design7.1 | Comprehensive computational design of ordered peptide macrocycles. | D A Silva, D Baker, D E Kim, F Pardo-Avila, G Bhardwaj, G Varani, I K Webb, J N Adkins, J R Cort, M D Shortridge, P Hosseinzadeh, S A Rettie, T W Craven, V K Mulligan, Y M Ibrahim |
30204 | Chemical Shifts: 1 set Spectral_peak_list: 2 sets |
Solution structure of the de novo mini protein gHH_44 | Accurate de novo design of hyperstable constrained peptides | Alexander Eletsky, Andrew Watkins, Christopher D Bahl, Colin E Correnti, David Baker, David J Craik, Evangelos Coutsias, Gabriel J Rocklin, Garry W Buchko, Gaurav Bhardwaj, James M Olson, Jason M Gilmore, Lauren P Carter, Olivier Cheneval, Per Jr J Greisen, Peta J Harvey, Po-Ssu S Huang, Quentin Kaas, Richard Bonneau, Stephen A Rettie, Surya V Pulavarti, Thomas Szyperski, Thomas W Linsky, Vikram Khipple K Mulligan, William A Johnsen, Xianzhong Xu, Yifan Song |
34032 | Chemical Shifts: 1 set |
Engineering protein stability with atomic precision in a monomeric miniprotein | Engineering protein stability with atomic precision in a monomeric miniprotein | C Williams, D N Woolfson, E G Baker, G G Bartlett, J W Heal, K L Hudson, K L Porter Goff, M P Crump, R B Sessions |
34033 | Chemical Shifts: 1 set |
Engineering protein stability with atomic precision in a monomeric miniprotein | Engineering protein stability with atomic precision in a monomeric miniprotein | C Williams, D N Woolfson, E G Baker, G G Bartlett, J W Heal, K L Hudson, K L Porter Goff, M P Crump, R B Sessions |
34031 | Chemical Shifts: 1 set |
Engineering protein stability with atomic precision in a monomeric miniprotein | Engineering protein stability with atomic precision in a monomeric miniprotein | C Williams, D N Woolfson, E G Baker, G G Bartlett, J W Heal, K L Hudson, K L Porter Goff, M P Crump, R B Sessions |
30146 | Chemical Shifts: 1 set |
NMR Solution Structure of Designed Peptide NC_cEE_D1 | Accurate de novo design of hyperstable constrained peptides. | A Eletsky, A Watkins, C D Bahl, C E Correnti, D Baker, D J Craik, E Coutsias, G Bhardwaj, G J Rocklin, G W Buchko, J M Gilmore, J M Olson, L P Carter, O Cheneval, P J Greisen, P J Harvey, P S Huang, Q Kaas, R Bonneau, S A Rettie, S V Pulavarti, T Szyperski, T W Linsky, V K Mulligan, W A Johnsen, X Xu, Y Song |
30144 | Chemical Shifts: 1 set |
NMR Solution Structure of Designed Peptide NC_cHh_DL_D1 | Accurate de novo design of hyperstable constrained peptides. | A Eletsky, A Watkins, C D Bahl, C E Correnti, D Baker, D J Craik, E Coutsias, G Bhardwaj, G J Rocklin, G W Buchko, J M Gilmore, J M Olson, L P Carter, O Cheneval, P J Greisen, P J Harvey, P S Huang, Q Kaas, R Bonneau, S A Rettie, S V Pulavarti, T Szyperski, T W Linsky, V K Mulligan, W A Johnsen, X Xu, Y Song |
30143 | Chemical Shifts: 1 set |
NMR Solution Structure of Designed Peptide NC_cHH_D1 | Accurate de novo design of hyperstable constrained peptides. | A Eletsky, A Watkins, C D Bahl, C E Correnti, D Baker, D J Craik, E Coutsias, G Bhardwaj, G J Rocklin, G W Buchko, J M Gilmore, J M Olson, L P Carter, O Cheneval, P J Greisen, P J Harvey, P S Huang, Q Kaas, R Bonneau, S A Rettie, S V Pulavarti, T Szyperski, T W Linsky, V K Mulligan, W A Johnsen, X Xu, Y Song |
30142 | Chemical Shifts: 1 set |
NMR Solution Structure of Designed Peptide NC_EEH_D1 | Accurate de novo design of hyperstable constrained peptides. | A Eletsky, A Watkins, C D Bahl, C E Correnti, D Baker, D J Craik, E Coutsias, G Bhardwaj, G J Rocklin, G W Buchko, J M Gilmore, J M Olson, L P Carter, O Cheneval, P J Greisen, P J Harvey, P S Huang, Q Kaas, R Bonneau, S A Rettie, S V Pulavarti, T Szyperski, T W Linsky, V K Mulligan, W A Johnsen, X Xu, Y Song |
30145 | Chemical Shifts: 1 set |
NMR Solution Structure of Designed Peptide NC_cHHH_D1 | Accurate de novo design of hyperstable constrained peptides. | A Eletsky, A Watkins, C D Bahl, C E Correnti, D Baker, D J Craik, E Coutsias, G Bhardwaj, G J Rocklin, G W Buchko, J M Gilmore, J M Olson, L P Carter, O Cheneval, P J Greisen, P J Harvey, P S Huang, Q Kaas, R Bonneau, S A Rettie, S V Pulavarti, T Szyperski, T W Linsky, V K Mulligan, W A Johnsen, X Xu, Y Song |
30141 | Chemical Shifts: 1 set |
NMR Solution Structure of Designed Peptide NC_EEH_D2 | Accurate de novo design of hyperstable constrained peptides. | A Eletsky, A Watkins, C D Bahl, C E Correnti, D Baker, D J Craik, E Coutsias, G Bhardwaj, G J Rocklin, G W Buchko, J M Gilmore, J M Olson, L P Carter, O Cheneval, P J Greisen, P J Harvey, P S Huang, Q Kaas, R Bonneau, S A Rettie, S V Pulavarti, T Szyperski, T W Linsky, V K Mulligan, W A Johnsen, X Xu, Y Song |
30140 | Chemical Shifts: 1 set |
NMR Solution Structure of Designed Peptide NC_EHE_D1 | Accurate de novo design of hyperstable constrained peptides. | A Eletsky, A Watkins, C D Bahl, C E Correnti, D Baker, D J Craik, E Coutsias, G Bhardwaj, G J Rocklin, G W Buchko, J M Gilmore, J M Olson, L P Carter, O Cheneval, P J Greisen, P J Harvey, P S Huang, Q Kaas, R Bonneau, S A Rettie, S V Pulavarti, T Szyperski, T W Linsky, V K Mulligan, W A Johnsen, X Xu, Y Song |
30138 | Chemical Shifts: 1 set |
NMR Solution Structure of Designed Peptide NC_HEE_D1 | Accurate de novo design of hyperstable constrained peptides. | A Eletsky, A Watkins, C D Bahl, C E Correnti, D Baker, D J Craik, E Coutsias, G Bhardwaj, G J Rocklin, G W Buchko, J M Gilmore, J M Olson, L P Carter, O Cheneval, P J Greisen, P J Harvey, P S Huang, Q Kaas, R Bonneau, S A Rettie, S V Pulavarti, T Szyperski, T W Linsky, V K Mulligan, W A Johnsen, X Xu, Y Song |
26045 | Chemical Shifts: 1 set Spectral_peak_list: 2 sets |
Solution structure of the de novo mini protein HHH_06 | Accurate de novo design of hyperstable constrained peptides. | A Eletsky, A Watkins, C D Bahl, C E Correnti, D Baker, D J Craik, E Coutsias, G Bhardwaj, G J Rocklin, G W Buchko, J M Gilmore, J M Olson, L P Carter, O Cheneval, P J Greisen, P J Harvey, P S Huang, Q Kaas, R Bonneau, S A Rettie, S V Pulavarti, T Szyperski, T W Linsky, V K Mulligan, W A Johnsen, X Xu, Y Song |
26046 | Chemical Shifts: 1 set Spectral_peak_list: 2 sets |
Solution structure of the de novo mini protein EEH_04 | Accurate de novo design of hyperstable constrained peptides. | A Eletsky, A Watkins, C D Bahl, C E Correnti, D Baker, D J Craik, E Coutsias, G Bhardwaj, G J Rocklin, G W Buchko, J M Gilmore, J M Olson, L P Carter, O Cheneval, P J Greisen, P J Harvey, P S Huang, Q Kaas, R Bonneau, S A Rettie, S V Pulavarti, T Szyperski, T W Linsky, V K Mulligan, W A Johnsen, X Xu, Y Song |
30069 | Chemical Shifts: 1 set Spectral_peak_list: 2 sets |
Solution structure of the de novo miniprotein EEHE_02 | Accurate de novo design of hyperstable constrained peptides. | A Eletsky, A Watkins, C D Bahl, C E Correnti, D Baker, D J Craik, E Coutsias, G Bhardwaj, G J Rocklin, G W Buchko, J M Gilmore, J M Olson, L P Carter, O Cheneval, P J Greisen, P J Harvey, P S Huang, Q Kaas, R Bonneau, S A Rettie, S V Pulavarti, T Szyperski, T W Linsky, V K Mulligan, W A Johnsen, X Xu, Y Song |
30067 | Chemical Shifts: 1 set Spectral_peak_list: 2 sets |
Solution structure of the de novo miniprotein EHE_06 | Accurate de novo design of hyperstable constrained peptides. | A Eletsky, A Watkins, C D Bahl, C E Correnti, D Baker, D J Craik, E Coutsias, G Bhardwaj, G J Rocklin, G W Buchko, J M Gilmore, J M Olson, L P Carter, O Cheneval, P J Greisen, P J Harvey, P S Huang, Q Kaas, R Bonneau, S A Rettie, S V Pulavarti, T Szyperski, T W Linsky, V K Mulligan, W A Johnsen, X Xu, Y Song |
30050 | Chemical Shifts: 1 set |
Solution structure of Ras Binding Domain (RBD) of B-Raf | A Small Molecule RAS-Mimetic Disrupts RAS Association with Effector Proteins to Block Signaling | A K Aggarwal, C Guha, D Mulholland, E P Reddy, I Basu, J R Hart, K Dutta, L Ueno, M V Reddy, P K Vogt, R Vasquez-Del Carpio, S C Cosenza, S J Baker, S K Athuluri-Divakar, Y K Gupta |
30048 | Chemical Shifts: 1 set |
Solution structure of Ras Binding Domain (RBD) of B-Raf complexed with Rigosertib (Complex I) | A Small Molecule RAS-Mimetic Disrupts RAS Association with Effector Proteins to Block Signaling | A K Aggarwal, C Guha, D Mulholland, E P Reddy, I Basu, J R Hart, K Dutta, L Ueno, M V Reddy, P K Vogt, R Vasquez-Del Carpio, S C Cosenza, S J Baker, S K Athuluri-Divakar, Y K Gupta |
30047 | Chemical Shifts: 1 set |
Solution structure of Ras Binding Domain (RBD) of B-Raf | A Small Molecule RAS-Mimetic Disrupts RAS Association with Effector Proteins to Block Signaling. | A K Aggarwal, C Guha, D Mulholland, E P Reddy, I Basu, J R Hart, K Dutta, L Ueno, M V Reddy, P K Vogt, R Vasquez-Del Carpio, S C Cosenza, S J Baker, S K Athuluri-Divakar, Y K Gupta |
25527 | Chemical Shifts: 1 set |
Chemical shift assignments and structure of the alpha-crystallin domain from human, HSPB5 | A conserved histidine modulates HSPB5 structure to trigger chaperone activity in response to stress-related acidosis | Andrew J Borst, Daniel R Southworth, David Baker, Eric Tse, Katja D Dove, Lei Shi, Ponni Rajagopal, Rachel E Klevit, Scott P Delbecq |
18837 | Chemical Shifts: 1 set |
15N, 13C and 1H Resonance Assignments and Secondary Structure Determination of a Variable Heavy Chain Antibody | (15)N, (13)C and (1)H resonance assignments and secondary structure determination of a variable heavy domain of a heavy chain antibody | Alastair D G Lawson, Alastair S Baker, Alistair J Henry, Christine E Prosser, Frederick W Muskett, Jorg Kinne, Laura M Griffin, Lorna C Waters, Mark D Carr, Philip W Addis, Richard J Taylor, Ulrich Wernery, Vaclav Veverka |
16145 | Chemical Shifts: 1 set |
Structure of SDF-1/CXCL12 | Monomeric structure of the cardioprotective chemokine SDF-1/CXCL12 | B F Volkman, C T Veldkamp, F C Peterson, H Basnet, J E Baker, J J Weiner, J J Ziarek, J Su, R Lennertz |
16142 | Chemical Shifts: 1 set |
Structure of SDF-1/CXCL12 | Monomeric structure of the cardioprotective chemokine SDF-1/CXCL12 | B F Volkman, C T Veldkamp, F C Peterson, H Basnet, J E Baker, J J Weiner, J J Ziarek, J Su, R Lennertz |
16143 | Chemical Shifts: 1 set |
Structure of SDF-1/CXCL12 | Monomeric structure of the cardioprotective chemokine SDF-1/CXCL12 | B F Volkman, C T Veldkamp, F C Peterson, H Basnet, J E Baker, J J Weiner, J J Ziarek, J Su, R Lennertz |
7102 | Chemical Shifts: 1 set |
High-resolution structural and thermodynamic analysis of extreme stabilization of human procarboxypeptidase by computational protein design | High-resolution structural and thermodynamic analysis of extreme stabilization of human procarboxypeptidase by computational protein design | B Kuhlman, C Corrent, D Baker, E A Merritt, G Dantas, G Varani, J J Havranek, N G Isern, S L Reichow, Z M Eletr |