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6Z98
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BU of 6z98 by Molmil
NMR solution structure of the peach allergen Pru p 1.0101
分子名称: Major allergen Pru p 1
著者Eidelpes, R, Fuehrer, S, Hofer, F, Kamenik, A.S, Liedl, K.R, Tollinger, M.
登録日2020-06-03
公開日2021-06-30
最終更新日2024-05-15
実験手法SOLUTION NMR
主引用文献Structure and Zeatin Binding of the Peach Allergen Pru p 1 .
J.Agric.Food Chem., 69, 2021
5VLN
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BU of 5vln by Molmil
NMR structure of the N-domain of troponin C bound to switch region of troponin I
分子名称: Troponin C, slow skeletal and cardiac muscles,Troponin I, cardiac muscle
著者Cai, F, Hwang, P.M, Sykes, B.D.
登録日2017-04-25
公開日2017-05-24
最終更新日2024-05-15
実験手法SOLUTION NMR
主引用文献Structures reveal details of small molecule binding to cardiac troponin.
J. Mol. Cell. Cardiol., 101, 2016
7UH9
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BU of 7uh9 by Molmil
NMR structure of the cNTnC-cTnI chimera bound to W8
分子名称: CALCIUM ION, N-(7-aminoheptyl)-5-chloronaphthalene-1-sulfonamide, Troponin C, ...
著者Cai, F, Kampourakis, T, Cockburn, K.T, Sykes, B.D.
登録日2022-03-26
公開日2022-06-15
最終更新日2024-05-15
実験手法SOLUTION NMR
主引用文献Drugging the Sarcomere, a Delicate Balance: Position of N-Terminal Charge of the Inhibitor W7.
Acs Chem.Biol., 17, 2022
7UHA
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BU of 7uha by Molmil
NMR structure of the cNTnC-cTnI chimera bound to W6
分子名称: CALCIUM ION, N-(5-aminopentyl)-5-chloronaphthalene-1-sulfonamide, Troponin C, ...
著者Cai, F, Kampourakis, T, Cockburn, K.T, Sykes, B.D.
登録日2022-03-26
公開日2022-06-15
最終更新日2024-05-15
実験手法SOLUTION NMR
主引用文献Drugging the Sarcomere, a Delicate Balance: Position of N-Terminal Charge of the Inhibitor W7.
Acs Chem.Biol., 17, 2022
7TA8
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BU of 7ta8 by Molmil
NMR structure of crosslinked cyclophilin A
分子名称: Peptidyl-prolyl cis-trans isomerase A
著者Lu, M, Toptygin, D, Xiang, Y, Shi, Y, Schwieters, C.D, Lipinski, E.C, Ahn, J, Byeon, I.-J.L, Gronenborn, A.M.
登録日2021-12-20
公開日2022-06-01
最終更新日2023-06-14
実験手法SOLUTION NMR
主引用文献The Magic of Linking Rings: Discovery of a Unique Photoinduced Fluorescent Protein Crosslink.
J.Am.Chem.Soc., 144, 2022
5W88
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BU of 5w88 by Molmil
NMR structure of the N-domain of troponin C bound to switch region of troponin I and 3-methyldiphenylamine (peptide mode)
分子名称: 3-methyl-N-phenylaniline, Troponin C, Troponin I
著者Cai, F, Hwang, P.M, Sykes, B.D.
登録日2017-06-21
公開日2017-07-12
最終更新日2024-05-15
実験手法SOLUTION NMR
主引用文献Structures reveal details of small molecule binding to cardiac troponin.
J. Mol. Cell. Cardiol., 101, 2016
5WCL
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BU of 5wcl by Molmil
NMR structure of the N-domain of troponin C bound to switch region of troponin I and 3-methyldiphenylamine (solvent exposed mode)
分子名称: 3-methyl-N-phenylaniline, Troponin C, slow skeletal and cardiac muscles,Troponin I, ...
著者Cai, F, Hwang, P.M, Sykes, B.D.
登録日2017-06-30
公開日2017-07-19
最終更新日2024-05-15
実験手法SOLUTION NMR
主引用文献Structures reveal details of small molecule binding to cardiac troponin.
J. Mol. Cell. Cardiol., 101, 2016
4A52
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BU of 4a52 by Molmil
NMR structure of the imipenem-acylated L,D-transpeptidase from Bacillus subtilis
分子名称: (5R)-5-[(1S,2R)-1-formyl-2-hydroxypropyl]-3-[(2-{[(E)-iminomethyl]amino}ethyl)sulfanyl]-4,5-dihydro-1H-pyrrole-2-carboxylic acid, PUTATIVE L, D-TRANSPEPTIDASE YKUD
著者Lecoq, L, Simorre, J, Bougault, C, Arthur, M, Hugonnet, J, Veckerle, C, Pessey, O.
登録日2011-10-24
公開日2012-05-30
最終更新日2018-01-24
実験手法SOLUTION NMR
主引用文献Dynamics Induced by Beta-Lactam Antibiotics in the Active Site of Bacillus subtilis L,D-Transpeptidase.
Structure, 20, 2012
5LWC
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BU of 5lwc by Molmil
NMR solution structure of bacteriocin BacSp222 from Staphylococcus pseudintermedius 222
分子名称: Bacteriocin BacSp222
著者Nowakowski, M.E, Ejchart, A.O, Jaremko, L, Wladyka, B, Mak, P.
登録日2016-09-15
公開日2017-10-25
最終更新日2023-06-14
実験手法SOLUTION NMR
主引用文献Spatial attributes of the four-helix bundle group of bacteriocins - The high-resolution structure of BacSp222 in solution.
Int.J.Biol.Macromol., 107, 2018
7PVM
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BU of 7pvm by Molmil
NMR structure of the C. thermophilum Xrn2 zinc finger
分子名称: 5'-3' exoribonuclease, ZINC ION
著者Overbeck, J.H, Sprangers, R, Wurm, J.P.
登録日2021-10-05
公開日2022-07-06
最終更新日2024-06-19
実験手法SOLUTION NMR
主引用文献Observation of conformational changes that underlie the catalytic cycle of Xrn2.
Nat.Chem.Biol., 18, 2022
6W4F
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BU of 6w4f by Molmil
NMR-driven structure of KRAS4B-GDP homodimer on a lipid bilayer nanodisc
分子名称: 1,2-DIOLEOYL-SN-GLYCERO-3-PHOSPHOCHOLINE, Apolipoprotein A-I, GTPase KRas, ...
著者Lee, K, Fang, Z, Enomoto, M, Gasmi-Seabrook, G.M, Zheng, L, Marshall, C.B, Ikura, M.
登録日2020-03-10
公開日2020-04-29
最終更新日2024-05-15
実験手法SOLUTION NMR
主引用文献Two Distinct Structures of Membrane-Associated Homodimers of GTP- and GDP-Bound KRAS4B Revealed by Paramagnetic Relaxation Enhancement.
Angew.Chem.Int.Ed.Engl., 59, 2020
7WIO
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BU of 7wio by Molmil
NMR structure of N-terminal domain of Triconephila clavipes of major ampullate spidroin 1
分子名称: Major ampullate spidroin 1A
著者Oktaviani, N.A, Malay, A.D, Matsugami, A, Hayashi, F, Numata, K.
登録日2022-01-04
公開日2023-03-15
最終更新日2024-05-15
実験手法SOLUTION NMR
主引用文献Unusual p K a Values Mediate the Self-Assembly of Spider Dragline Silk Proteins.
Biomacromolecules, 24, 2023
6W4E
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BU of 6w4e by Molmil
NMR-driven structure of KRAS4B-GTP homodimer on a lipid bilayer nanodisc
分子名称: 1,2-DIOLEOYL-SN-GLYCERO-3-PHOSPHOCHOLINE, 5'-GUANOSINE-DIPHOSPHATE-MONOTHIOPHOSPHATE, Apolipoprotein A-I, ...
著者Lee, K, Fang, Z, Enomoto, M, Gasmi-Seabrook, G.M, Zheng, L, Marshall, C.B, Ikura, M.
登録日2020-03-10
公開日2020-04-15
最終更新日2024-05-01
実験手法SOLUTION NMR
主引用文献Two Distinct Structures of Membrane-Associated Homodimers of GTP- and GDP-Bound KRAS4B Revealed by Paramagnetic Relaxation Enhancement.
Angew.Chem.Int.Ed.Engl., 59, 2020
6WPD
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BU of 6wpd by Molmil
NMR Structure of HSP1-NH2 antimicrobial peptide in presence of DPC-d38 micelles
分子名称: HSP1-NH2
著者Verly, R.M, Gomes, I.P.
登録日2020-04-27
公開日2020-09-02
最終更新日2020-09-16
実験手法SOLUTION NMR
主引用文献Membrane interactions of the anuran antimicrobial peptide HSP1-NH2: Different aspects of the association to anionic and zwitterionic biomimetic systems.
Biochim Biophys Acta Biomembr, 1863, 2020
6WPB
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BU of 6wpb by Molmil
NMR Structure of HSP1-NH2 antimicrobial peptide in presence of SDS-d25 micelles
分子名称: HSP1-NH2
著者Verly, R.M, Gomes, I.P.
登録日2020-04-27
公開日2020-09-02
最終更新日2020-09-16
実験手法SOLUTION NMR
主引用文献Membrane interactions of the anuran antimicrobial peptide HSP1-NH2: Different aspects of the association to anionic and zwitterionic biomimetic systems.
Biochim Biophys Acta Biomembr, 1863, 2020
7PQ4
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BU of 7pq4 by Molmil
NMR Structure of RgpB C-terminal Domain
分子名称: Arginine-specific cysteine proteinase (Arg-gingipain)
著者Dorgan, B.J, Curtis, M.A, Garnett, J.A.
登録日2021-09-16
公開日2022-09-28
最終更新日2024-06-19
実験手法SOLUTION NMR
主引用文献Structural Model of a Porphyromonas gingivalis type IX Secretion System Shuttle Complex.
J.Mol.Biol., 434, 2022
4Q02
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BU of 4q02 by Molmil
Second-site screening of K-Ras in the presence of covalently attached first-site ligands
分子名称: 3,4-difluorobenzenethiol, GTPase KRas, GUANOSINE-5'-DIPHOSPHATE, ...
著者Sun, Q, Phan, J, Friberg, A, Camper, D.V, Olejniczak, E.T, Fesik, S.W.
登録日2014-03-31
公開日2014-09-10
実験手法X-RAY DIFFRACTION (1.702 Å)
主引用文献A method for the second-site screening of K-Ras in the presence of a covalently attached first-site ligand.
J.Biomol.Nmr, 60, 2014
4Q03
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BU of 4q03 by Molmil
Second-site screening of K-Ras in the presence of covalently attached first-site ligands
分子名称: 4-bromobenzenethiol, GTPase KRas, GUANOSINE-5'-DIPHOSPHATE, ...
著者Sun, Q, Phan, J, Friberg, A, Camper, D.V, Olejniczak, E.T, Fesik, S.W.
登録日2014-03-31
公開日2014-09-10
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (1.201 Å)
主引用文献A method for the second-site screening of K-Ras in the presence of a covalently attached first-site ligand.
J.Biomol.Nmr, 60, 2014
4PZY
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BU of 4pzy by Molmil
Second-site screening of K-Ras in the presence of covalently attached first-site ligands
分子名称: 2-chloro-1-(1H-indol-3-yl)ethanone, GUANOSINE-5'-DIPHOSPHATE, K-Ras, ...
著者Sun, Q, Phan, J, Friberg, A, Camper, D.V, Olejniczak, E.T, Fesik, S.W.
登録日2014-03-31
公開日2014-09-10
実験手法X-RAY DIFFRACTION (1.88 Å)
主引用文献A method for the second-site screening of K-Ras in the presence of a covalently attached first-site ligand.
J.Biomol.Nmr, 60, 2014
6CAH
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BU of 6cah by Molmil
NMR-based structure of the FHA-2 domain from Mycobacterium tuberculosis ABC transporter Rv1747
分子名称: ABC transporter ATP-binding/permease protein Rv1747
著者Heinkel, F, Okon, M, Gsponer, J, McIntosh, L.P.
登録日2018-01-30
公開日2018-06-20
最終更新日2024-05-15
実験手法SOLUTION NMR
主引用文献Biophysical Characterization of the Tandem FHA Domain Regulatory Module from the Mycobacterium tuberculosis ABC Transporter Rv1747.
Structure, 26, 2018
5NZ9
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BU of 5nz9 by Molmil
NMR structure of an EphA2-Sam fragment
分子名称: Ephrin type-A receptor 2
著者Mercurio, F.A, Leone, M.
登録日2017-05-12
公開日2017-12-20
最終更新日2023-06-14
実験手法SOLUTION NMR
主引用文献The Sam-Sam interaction between Ship2 and the EphA2 receptor: design and analysis of peptide inhibitors.
Sci Rep, 7, 2017
4Q01
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BU of 4q01 by Molmil
Second-site screening of K-Ras in the presence of covalently attached first-site ligands
分子名称: GUANOSINE-5'-DIPHOSPHATE, K-Ras, MAGNESIUM ION, ...
著者Sun, Q, Phan, J, Friberg, A, Camper, D.V, Olejniczak, E.T, Fesik, S.W.
登録日2014-03-31
公開日2014-09-10
実験手法X-RAY DIFFRACTION (1.291 Å)
主引用文献A method for the second-site screening of K-Ras in the presence of a covalently attached first-site ligand.
J.Biomol.Nmr, 60, 2014
4PZZ
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BU of 4pzz by Molmil
Second-site screening of K-Ras in the presence of covalently attached first-site ligands
分子名称: 1H-benzimidazol-2-ylmethanethiol, GUANOSINE-5'-DIPHOSPHATE, K-Ras, ...
著者Sun, Q, Phan, J, Friberg, A, Camper, D.V, Olejniczak, E.T, Fesik, S.W.
登録日2014-03-31
公開日2014-09-10
実験手法X-RAY DIFFRACTION (1.403 Å)
主引用文献A method for the second-site screening of K-Ras in the presence of a covalently attached first-site ligand.
J.Biomol.Nmr, 60, 2014
6LXG
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BU of 6lxg by Molmil
NMR solution structure of regulatory ACT domain of the Mycobacterium tuberculosis Rel protein
分子名称: GTP pyrophosphokinase
著者Shin, J, Singal, B, Manimekalai, M.S.S, Gruber, G.
登録日2020-02-11
公開日2020-11-04
最終更新日2024-05-15
実験手法SOLUTION NMR
主引用文献Atomic structure of, and valine binding to the regulatory ACT domain of the Mycobacterium tuberculosis Rel protein.
Febs J., 288, 2021
8B1L
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BU of 8b1l by Molmil
NMR structure of the antimicrobial peptide Of-Pis1 in DPC micelles
分子名称: Piscidin
著者Alaimo, N, Bischetti, M, Gallo, M, Cicero, D.O.
登録日2022-09-10
公開日2022-11-23
最終更新日2024-06-19
実験手法SOLUTION NMR
主引用文献Structural insights on the selective interaction of the histidine-rich piscidin antimicrobial peptide Of-Pis1 with membranes.
Biochim Biophys Acta Biomembr, 1865, 2022

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