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5EKJ
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Human Carbonic Anhydrase II complexed with a two-faced guest
分子名称: 2-(butylamino)-~{N}-[2-(4-sulfamoylphenyl)ethyl]ethanamide, Carbonic anhydrase 2, GLYCEROL, ...
著者Roose, B.W, Dmochowski, I.J.
登録日2015-11-03
公開日2016-01-06
最終更新日2024-03-06
実験手法X-RAY DIFFRACTION (1.129 Å)
主引用文献Programming A Molecular Relay for Ultrasensitive Biodetection through (129) Xe NMR.
Angew.Chem.Int.Ed.Engl., 55, 2016
5EKH
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BU of 5ekh by Molmil
Human Carbonic Anhydrase II complexed with a two-faced guest
分子名称: 4-(butylaminomethyl)benzenesulfonamide, Carbonic anhydrase 2, GLYCEROL, ...
著者Roose, B.W, Dmochowksi, I.J.
登録日2015-11-03
公開日2016-01-06
最終更新日2023-09-27
実験手法X-RAY DIFFRACTION (1.34 Å)
主引用文献Programming A Molecular Relay for Ultrasensitive Biodetection through (129) Xe NMR.
Angew.Chem.Int.Ed.Engl., 55, 2016
5AX2
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BU of 5ax2 by Molmil
Crystal structure of S.cerevisiae Kti11p
分子名称: CADMIUM ION, Diphthamide biosynthesis protein 3
著者Kumar, A, Nagarathinam, K, Tanabe, M, Balbach, J.
登録日2015-07-13
公開日2016-07-20
最終更新日2019-02-20
実験手法X-RAY DIFFRACTION (2.4 Å)
主引用文献Hyperbolic Pressure-Temperature Phase Diagram of the Zinc-Finger Protein apoKti11 Detected by NMR Spectroscopy.
J Phys Chem B, 123, 2019
5EKM
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BU of 5ekm by Molmil
Human Carbonic Anhydrase II complexed with a two-faced guest
分子名称: 2-(butylamino)-~{N}-(4-sulfamoylphenyl)ethanamide, Carbonic anhydrase 2, GLYCEROL, ...
著者Roose, B.W, Dmochowski, I.J.
登録日2015-11-03
公開日2016-01-06
最終更新日2024-03-06
実験手法X-RAY DIFFRACTION (1.33 Å)
主引用文献Programming A Molecular Relay for Ultrasensitive Biodetection through (129) Xe NMR.
Angew.Chem.Int.Ed.Engl., 55, 2016
5FRG
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BU of 5frg by Molmil
The NMR Structure of the Cdc42-interacting region of TOCA1
分子名称: FORMIN-BINDING PROTEIN 1-LIKE
著者Watson, J.R, Nietlispach, D, Owen, D, Mott, H.R.
登録日2015-12-17
公開日2016-05-04
最終更新日2024-06-19
実験手法SOLUTION NMR
主引用文献Investigation of the Interaction between Cdc42 and its Effector Toca1: Handover of Cdc42 to the Actin Regulator N-Wasp is Facilitated by Differential Binding Affinities.
J.Biol.Chem., 291, 2016
6ZYB
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BU of 6zyb by Molmil
Sarcin-Ricin Loop RNA from Ecoli with a C2667-2'-OCF3 modification
分子名称: Sarcin-Ricin Loop RNA from Ecoli with a C2667-2'-OCF3 modification
著者Ennifar, E.
登録日2020-07-31
公開日2020-12-16
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (0.9 Å)
主引用文献2'- O -Trifluoromethylated RNA - a powerful modification for RNA chemistry and NMR spectroscopy.
Chem Sci, 11, 2020
6ZXZ
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BU of 6zxz by Molmil
Sarcin-Ricin Loop RNA from Ecoli with a A2670-2'-OCF3 modification
分子名称: POTASSIUM ION, SODIUM ION, Sarcin-Ricin Loop RNA from Ecoli with a A2670-2'-OCF3 modification
著者Ennifar, E.
登録日2020-07-30
公開日2020-12-16
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (2.44 Å)
主引用文献2'- O -Trifluoromethylated RNA - a powerful modification for RNA chemistry and NMR spectroscopy.
Chem Sci, 11, 2020
1VOP
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BU of 1vop by Molmil
CONSERVED RNA COMPONENT OF THE PEPTIDYL TRANSFERASE CENTER, NMR, 33 STRUCTURES
分子名称: 23S RIBOSOMAL RNA
著者Puglisi, E.V, Puglisi, J.D.
登録日1997-08-30
公開日1997-12-24
最終更新日2024-05-22
実験手法SOLUTION NMR
主引用文献Structure of a conserved RNA component of the peptidyl transferase centre.
Nat.Struct.Biol., 4, 1997
1MP6
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BU of 1mp6 by Molmil
Structure of the transmembrane region of the M2 protein H+ channel by solid state NMR spectroscopy
分子名称: Matrix protein M2
著者Wang, J, Kim, S, Kovacs, F, Cross, T.A.
登録日2002-09-11
公開日2002-09-25
最終更新日2024-05-22
実験手法SOLID-STATE NMR
主引用文献Structure of the transmembrane region of the M2 protein H(+) channel.
Protein Sci., 10, 2001
4Q49
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BU of 4q49 by Molmil
Room temperature neutron crystal structure of apo human carbonic anhydrase at pH 7.5
分子名称: Carbonic anhydrase 2, ZINC ION
著者Fisher, S.Z, McKenna, R.
登録日2014-04-14
公開日2015-02-25
最終更新日2023-09-20
実験手法NEUTRON DIFFRACTION (1.8 Å)
主引用文献Joint neutron crystallographic and NMR solution studies of Tyr residue ionization and hydrogen bonding: Implications for enzyme-mediated proton transfer.
Proc.Natl.Acad.Sci.USA, 112, 2015
4QZS
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BU of 4qzs by Molmil
Crystal structure of the first bromodomain of human 3-fluoro tyrosine-labeled brd4 in complex with jq1
分子名称: (6S)-6-(2-tert-butoxy-2-oxoethyl)-4-(4-chlorophenyl)-2,3,9-trimethyl-6,7-dihydrothieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepin-10-ium, 1,2-ETHANEDIOL, Bromodomain-containing protein 4, ...
著者Ember, S.W, Schonbrunn, E.
登録日2014-07-28
公開日2014-10-29
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (1.45 Å)
主引用文献Fluorinated aromatic amino acids are sensitive (19)f NMR probes for bromodomain-ligand interactions.
Acs Chem.Biol., 9, 2014
5ID3
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BU of 5id3 by Molmil
Solution structure of the pore-forming region of C. elegans Mitochondrial Calcium Uniporter (MCU)
分子名称: Mitochondrial Calcium Uniporter
著者Oxenoid, K, Dong, Y, Cao, C, Cui, T, Sancak, Y, Markhard, A.L, Grabarek, Z, Kong, L, Liu, Z, Ouyang, B, Cong, Y, Mootha, V.K, Chou, J.J, Membrane Protein Structures by Solution NMR (MPSbyNMR)
登録日2016-02-23
公開日2016-05-04
最終更新日2024-05-15
実験手法SOLUTION NMR
主引用文献Architecture of the mitochondrial calcium uniporter.
Nature, 533, 2016
1MB6
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BU of 1mb6 by Molmil
Three dimensional solution structure of huwentoxin-IV by 2D 1H-NMR
分子名称: huwentoxin-iv
著者Peng, K, Shu, Q, Liang, S.P.
登録日2002-08-02
公開日2002-08-21
最終更新日2017-11-29
実験手法SOLUTION NMR
主引用文献Function and solution structure of huwentoxin-IV, a potent neuronal tetrodotoxin (TTX)-sensitive sodium channel antagonist from Chinese bird spider Selenocosmia huwena
J.Biol.Chem., 277, 2002
8ONG
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BU of 8ong by Molmil
Structure of the endothelial monocyte activating polypeptide II (EMAP II) in solution
分子名称: Aminoacyl tRNA synthase complex-interacting multifunctional protein 1
著者Lozhko, D, Kolomiiets, L, Kornelyuk, A.I, Zhukov, I.
登録日2023-04-02
公開日2024-04-10
実験手法SOLUTION NMR, SOLUTION SCATTERING
主引用文献Structural analysis and conformational flexibility of endothelial monocyte activating polypeptide II (EMAP II) by means NMR spectroscopy and molecular dynamics simulations
To Be Published
4YU9
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BU of 4yu9 by Molmil
Crystal Structure of double mutant Y115E Y117E human Glutaminyl Cyclase
分子名称: 1,2-ETHANEDIOL, Glutaminyl-peptide cyclotransferase, SULFATE ION, ...
著者Di Pisa, F, Pozzi, C, Benvenuti, M, Mangani, S.
登録日2015-03-18
公開日2015-08-05
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献The soluble Y115E-Y117E variant of human glutaminyl cyclase is a valid target for X-ray and NMR screening of inhibitors against Alzheimer disease.
Acta Crystallogr.,Sect.F, 71, 2015
4YWY
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BU of 4ywy by Molmil
Crystal Structure of double mutant Y115E Y117E human Glutaminyl Cyclase in complex with inhibitor PBD-150
分子名称: 1,2-ETHANEDIOL, 1-(3,4-dimethoxyphenyl)-3-[3-(1H-imidazol-1-yl)propyl]thiourea, CHLORIDE ION, ...
著者Di Pisa, F, Pozzi, C, Benvenuti, M, Mangani, S.
登録日2015-03-21
公開日2015-08-05
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (1.95 Å)
主引用文献The soluble Y115E-Y117E variant of human glutaminyl cyclase is a valid target for X-ray and NMR screening of inhibitors against Alzheimer disease.
Acta Crystallogr.,Sect.F, 71, 2015
5LS3
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BU of 5ls3 by Molmil
Crystal structure of metallo-beta-lactamase SPM-1 with Y58C mutation
分子名称: Beta-lactamase IMP-1, ZINC ION
著者Hinchliffe, P, Spencer, J.
登録日2016-08-22
公開日2017-03-15
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (1.754 Å)
主引用文献(19) F-NMR Reveals the Role of Mobile Loops in Product and Inhibitor Binding by the Sao Paulo Metallo-beta-Lactamase.
Angew. Chem. Int. Ed. Engl., 56, 2017
7MPA
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BU of 7mpa by Molmil
Structure and topology of DWORF in bicelles by oriented solid-state NMR
分子名称: Sarcoplasmic/endoplasmic reticulum calcium ATPase regulator DWORF
著者Reddy, U.V, Weber, D.K, Veglia, G.V.
登録日2021-05-04
公開日2021-06-30
最終更新日2024-05-15
実験手法SOLID-STATE NMR
主引用文献A kink in DWORF helical structure controls the activation of the sarcoplasmic reticulum Ca 2+ -ATPase.
Structure, 30, 2022
7CKG
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BU of 7ckg by Molmil
Crystal structure of TMSiPheRS complexed with TMSiPhe
分子名称: 4-(trimethylsilyl)-L-phenylalanine, Tyrosine--tRNA ligase
著者Sun, J.P, Wang, J.Y, Zhu, Z.L, He, Q.T, Xiao, P.
登録日2020-07-17
公開日2021-03-31
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (2.053 Å)
主引用文献DeSiphering receptor core-induced and ligand-dependent conformational changes in arrestin via genetic encoded trimethylsilyl 1 H-NMR probe.
Nat Commun, 11, 2020
7CKH
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BU of 7ckh by Molmil
Crystal structure of TMSiPheRS
分子名称: Tyrosine--tRNA ligase
著者Sun, J.P, Wang, J.Y, Zhu, Z.L, He, Q.T, Xiao, P.
登録日2020-07-17
公開日2021-03-31
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (1.79492676 Å)
主引用文献DeSiphering receptor core-induced and ligand-dependent conformational changes in arrestin via genetic encoded trimethylsilyl 1 H-NMR probe.
Nat Commun, 11, 2020
7BV9
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BU of 7bv9 by Molmil
The NMR structure of the BEN domain from human NAC1
分子名称: Nucleus accumbens-associated protein 1
著者Nagata, T, Kobayashi, N, Nakayama, N, Obayashi, E, Urano, T.
登録日2020-04-09
公開日2021-02-17
最終更新日2024-05-15
実験手法SOLUTION NMR
主引用文献Nucleus Accumbens-Associated Protein 1 Binds DNA Directly through the BEN Domain in a Sequence-Specific Manner.
Biomedicines, 8, 2020
7K3S
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BU of 7k3s by Molmil
Solution NMR Structure of the Coiled-coil BRCA1-PALB2 Heterodimer
分子名称: Breast cancer type 1 susceptibility protein homolog, Partner and localizer of BRCA2
著者Daigham, N.S, Liu, G, Bunting, S.F, Montelione, G.T.
登録日2020-09-13
公開日2021-09-29
最終更新日2024-05-15
実験手法SOLUTION NMR
主引用文献The Structural Basis for Interactions Between PALB2 and BRCA1 that Mediate the Homologous Recombination DNA Damage Repair Process
To Be Published
7JYN
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BU of 7jyn by Molmil
Solution NMR structure of human Brd3 ET complexed with NSD3(148-184) peptide
分子名称: Bromodomain-containing protein 3, Histone-lysine N-methyltransferase NSD3
著者Aiyer, S, Swapna, G.V.T, Roth, M.J, Montelione, G.T.
登録日2020-08-31
公開日2021-06-23
最終更新日2024-05-15
実験手法SOLUTION NMR
主引用文献A common binding motif in the ET domain of BRD3 forms polymorphic structural interfaces with host and viral proteins.
Structure, 29, 2021
4GKA
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BU of 4gka by Molmil
Crystal structure of purine nucleoside phosphorylase (W16Y, W94Y, W178Y, H257W) mutant from human complexed with phosphate
分子名称: GLYCEROL, PHOSPHATE ION, Purine nucleoside phosphorylase
著者Haapalainen, A.M, Ho, M.C, Suarez, J.J, Almo, S.C, Schramm, V.L.
登録日2012-08-10
公開日2013-02-06
最終更新日2024-05-22
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Catalytic Site Conformations in Human PNP by (19)F-NMR and Crystallography.
Chem.Biol., 20, 2013
7EH3
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BU of 7eh3 by Molmil
Structure of Nanobody Nb23 in solution using NMR spectroscopy
分子名称: Nb23
著者Percipalle, M, Hunashal, Y, Esposito, G, Fogolari, F.
登録日2021-03-28
公開日2021-07-14
最終更新日2023-06-14
実験手法SOLUTION NMR
主引用文献Structure of Nanobody Nb23.
Molecules, 26, 2021

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