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7Z1F
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BU of 7z1f by Molmil
Crystal structure of GSK3b in complex with CX-4945
分子名称: 5-[(3-chlorophenyl)amino]benzo[c][2,6]naphthyridine-8-carboxylic acid, Glycogen synthase kinase-3 beta, IMIDAZOLE, ...
著者Grygier, P, Pustelny, K, Dubin, G, Czarna, A.
登録日2022-02-24
公開日2023-03-08
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (3 Å)
主引用文献Crystal structure of phosphorylated (Tyr216) GSK3b kinase in complex with CX-4945
To Be Published
7Z0K
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BU of 7z0k by Molmil
human PEX13 SH3 in complex with PEX5 W4 (WxxxF/Y) motif
分子名称: Peroxisomal membrane protein PEX13,Peroxisomal targeting signal 1 receptor
著者Gaussmann, S, Napolitano, V, sattler, M.
登録日2022-02-23
公開日2023-03-08
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Intramolecular autoinhibition of human PEX13 modulates peroxisomal import
Biorxiv, 2022
7Z0J
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BU of 7z0j by Molmil
human PEX13 SH3 domain in complex with internal FxxxF motif
分子名称: 1,2-ETHANEDIOL, Peroxisomal membrane protein PEX13
著者Gaussmann, S, Zak, K, Kreisz, N, Sattler, M.
登録日2022-02-23
公開日2023-03-08
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Intramolecular autoinhibition of human PEX13 modulates peroxisomal import
Biorxiv, 2022
8QZD
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BU of 8qzd by Molmil
Soluble epoxide hydrolase in complex with Epoxykinin
分子名称: 1,2-ETHANEDIOL, 2-[5-bromanyl-3-[2,2,2-tris(fluoranyl)ethanoyl]indol-1-yl]-N-cycloheptyl-ethanamide, BROMIDE ION, ...
著者Kumar, A, Ehrler, J.M.H, Ziegler, S, Doetsch, L, Proschak, E, Knapp, S, Structural Genomics Consortium (SGC)
登録日2023-10-27
公開日2024-02-28
最終更新日2024-04-03
実験手法X-RAY DIFFRACTION (1.3 Å)
主引用文献Discovery of the sEH Inhibitor Epoxykynin as a Potent Kynurenine Pathway Modulator.
J.Med.Chem., 67, 2024
6ZUM
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BU of 6zum by Molmil
Crystal structure of dimethylated RSL-N23H (RSL-B3) in complex with cucurbit[7]uril and zinc
分子名称: ACETATE ION, Fucose-binding lectin protein, SODIUM ION, ...
著者Guagnini, F, Engilberge, S, Flood, R.J, Ramberg, K.O, Crowley, P.B.
登録日2020-07-23
公開日2020-11-25
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (1.589 Å)
主引用文献Metal-Mediated Protein-Cucurbituril Crystalline Architectures
Cryst.Growth Des., 2020
6HXK
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BU of 6hxk by Molmil
Structure of the citryl-CoA lyase core module of human ATP citrate lyase in complex with citrate
分子名称: 1,2-ETHANEDIOL, ATP-citrate synthase, CITRATE ANION, ...
著者Verstraete, K, Verschueren, K.
登録日2018-10-17
公開日2019-04-10
最終更新日2024-05-01
実験手法X-RAY DIFFRACTION (1.85 Å)
主引用文献Structure of ATP citrate lyase and the origin of citrate synthase in the Krebs cycle.
Nature, 568, 2019
7Q14
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BU of 7q14 by Molmil
Crystal Structure of a Class D Carbapenemase_K73ALY Complexed with Imipenem
分子名称: 1-BUTANOL, BROMIDE ION, Beta-lactamase, ...
著者Zhou, Q, He, Y, Jin, Y.
登録日2021-10-18
公開日2022-11-16
最終更新日2024-10-23
実験手法X-RAY DIFFRACTION (2.15 Å)
主引用文献An Ion-Pair Induced Intermediate Complex Captured in Class D Carbapenemase Reveals Chloride Ion as a Janus Effector Modulating Activity
Acs Cent.Sci., 2023
7LDO
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BU of 7ldo by Molmil
G150T Pseudomonas fluorescens isocyanide hydratase (G150T-3) at 274K, Phenix-refined
分子名称: Isonitrile hydratase InhA
著者Su, Z, Dasgupta, M, Yoon, C.H, Wilson, M.A.
登録日2021-01-13
公開日2021-02-03
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (1.1 Å)
主引用文献Reproducibility of protein x-ray diffuse scattering and potential utility for modeling atomic displacement parameters.
Struct Dyn., 8, 2021
7Z1I
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BU of 7z1i by Molmil
Plant myrosinase TGG1 from Arabidopsis thaliana
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, CALCIUM ION, ...
著者Gao, Y, Farmer, E, Jimenez-Sandoval, P, Santiago, J.
登録日2022-02-24
公開日2023-03-08
最終更新日2024-11-06
実験手法X-RAY DIFFRACTION (3.09 Å)
主引用文献Plant myrosinase TGG1 from Arabidopsis thaliana
To Be Published
7LFN
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BU of 7lfn by Molmil
Structure of Hyperglycosylated Human IgG1 Fc (Fc267_329)
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, IgG1 Fc (Fc267_329), alpha-D-mannopyranose-(1-3)-[alpha-D-mannopyranose-(1-6)]beta-D-mannopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-[alpha-L-fucopyranose-(1-6)]2-acetamido-2-deoxy-beta-D-glucopyranose, ...
著者Fields, J.K, Sundberg, E.J.
登録日2021-01-17
公開日2021-01-27
最終更新日2024-10-23
実験手法X-RAY DIFFRACTION (2.6 Å)
主引用文献Silent Antibodies: Generation of Hyperglycosylated FCs to Ablate Effector Functions
To Be Published
6BDA
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BU of 6bda by Molmil
Wild-type I-OnuI bound to A3G substrate (post-cleavage complex)
分子名称: Cleaved Cognate DNA strand, +11 sense, Cleaved cognate DNA strand, ...
著者Brown, C, Zhang, K, Laforet, M, McMurrough, T, Gloor, G.B, Edgell, D.R, Junop, M.
登録日2017-10-22
公開日2018-10-24
最終更新日2024-03-13
実験手法X-RAY DIFFRACTION (1.88 Å)
主引用文献Wild-type I-OnuI bound to A3G substrate (post-cleavage complex)
To Be Published
7Z0I
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BU of 7z0i by Molmil
human PEX13 SH3 domain
分子名称: 1,2-ETHANEDIOL, Peroxisomal membrane protein PEX13, ZINC ION
著者Gaussmann, S, Zak, K, Sattler, M.
登録日2022-02-23
公開日2023-03-08
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Intramolecular autoinhibition of human PEX13 modulates peroxisomal import
Biorxiv, 2022
7L66
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BU of 7l66 by Molmil
C-type carbohydrate-recognition domain 4 of the mannose receptor complexed with Methyl-GlcNAc
分子名称: CALCIUM ION, Macrophage mannose receptor 1, methyl 2-acetamido-2-deoxy-alpha-D-glucopyranoside
著者Weis, W.I, Feinberg, H.
登録日2020-12-23
公開日2021-02-03
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (1.75 Å)
主引用文献Structural analysis of carbohydrate binding by the macrophage mannose receptor CD206.
J.Biol.Chem., 296, 2021
6ZYP
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BU of 6zyp by Molmil
Structure of NDM-1 with 2-Mercaptomethyl-thiazolidine L-anti-1b
分子名称: (2~{S},4~{R})-2-ethoxycarbonyl-5,5-dimethyl-2-(sulfanylmethyl)-1,3-thiazolidine-4-carboxylic acid, Metallo-beta-lactamase type 2, SULFATE ION, ...
著者Hinchliffe, P, Spencer, J.
登録日2020-08-02
公開日2021-01-20
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (1.4 Å)
主引用文献2-Mercaptomethyl-thiazolidines use conserved aromatic-S interactions to achieve broad-range inhibition of metallo-beta-lactamases.
Chem Sci, 12, 2021
6HYB
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BU of 6hyb by Molmil
Zr(IV)-substituted Wells-Dawson binding to Hen Egg-White Lysozyme (HEWL)
分子名称: Lysozyme C, POTASSIUM ION, W-Zr-cluster
著者Vandebroek, L, Van Meervelt, L, Parac-Vogt, T.N.
登録日2018-10-19
公開日2019-10-30
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (1.964 Å)
主引用文献Noncovalent Complexes Formed between Metal-Substituted Polyoxometalates and Hen Egg White Lysozyme
Eur J Inorg Chem, 2019
7L84
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BU of 7l84 by Molmil
Hen Egg White Lysozyme by Native S-SAD at Room Temperature
分子名称: Lysozyme C
著者Greisman, J.B, Dalton, K.M, Hekstra, D.R.
登録日2020-12-30
公開日2021-01-13
最終更新日2024-10-16
実験手法X-RAY DIFFRACTION (1.7 Å)
主引用文献Native SAD phasing at room temperature.
Acta Crystallogr D Struct Biol, 78, 2022
7L9S
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BU of 7l9s by Molmil
Wild-type Pseudomonas fluorescens isocyanide hydratase (WT-2) at 274K, Refmac5-refined
分子名称: Isonitrile hydratase InhA
著者Su, Z, Dasgupta, M, Poitevin, F, Mathews, I.I, van den Bedem, H, Wall, M.E, Yoon, C.H, Wilson, M.A.
登録日2021-01-04
公開日2021-02-03
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (1.2 Å)
主引用文献Reproducibility of protein x-ray diffuse scattering and potential utility for modeling atomic displacement parameters.
Struct Dyn., 8, 2021
6BDG
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BU of 6bdg by Molmil
HFQ monomer in spacegroup p6 at 1.93 angstrom resolution
分子名称: RNA-binding protein Hfq
著者Brown, C, Zhang, K, Seo, C, Ellis, M.J, Hanniford, D.B, Junop, M.
登録日2017-10-23
公開日2017-11-01
最終更新日2024-03-13
実験手法X-RAY DIFFRACTION (1.964 Å)
主引用文献HFQ monomer in spacegroup p6 at 1.93 angstrom resolution
To Be Published
7L9W
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BU of 7l9w by Molmil
Wild-type Pseudomonas fluorescens isocyanide hydratase (WT-3) at 274K, Refmac5-refined
分子名称: Isonitrile hydratase InhA
著者Su, Z, Dasgupta, M, Poitevin, F, Mathews, I.I, van den Bedem, H, Wall, M.E, Yoon, C.H, Wilson, M.A.
登録日2021-01-05
公開日2021-02-03
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (1.199 Å)
主引用文献Reproducibility of protein x-ray diffuse scattering and potential utility for modeling atomic displacement parameters.
Struct Dyn., 8, 2021
6BDU
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BU of 6bdu by Molmil
Crystal structure of PprA from Deinococcus radiodurans
分子名称: DNA repair protein PprA
著者Szabla, R, Czerwinski, M, Junop, M.S.
登録日2017-10-24
公開日2018-09-05
最終更新日2024-10-09
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Crystal structure of PprA from Deinococcus radiodurans
To Be Published
7ZCD
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BU of 7zcd by Molmil
Mutant L39Y-L58F of recombinant bovine beta-lactoglobulin in complex with pramocaine
分子名称: Beta-lactoglobulin, Pramocaine, SULFATE ION
著者Loch, J.I, Kurpiewska, K, Bonarek, P.
登録日2022-03-27
公開日2023-04-05
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献beta-Lactoglobulin variants as potential carriers of pramoxine: Comprehensive structural and biophysical studies.
J.Mol.Recognit., 36, 2023
7LA0
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BU of 7la0 by Molmil
Pseudomonas fluorescens G150A isocyanide hydratase (G150A-2) at 274K, Refmac5-refined
分子名称: Isonitrile hydratase InhA
著者Su, Z, Dasgupta, M, Poitevin, F, Mathews, I.I, van den Bedem, H, Wall, M.E, Yoon, C.H, Wilson, M.A.
登録日2021-01-05
公開日2021-02-03
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (1.25 Å)
主引用文献Reproducibility of protein x-ray diffuse scattering and potential utility for modeling atomic displacement parameters.
Struct Dyn., 8, 2021
8R3D
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BU of 8r3d by Molmil
Crystal structure of Pent only at pH 8.8
分子名称: 2-acetamido-2-deoxy-alpha-D-glucopyranose, Beta propeller
著者Flood, R.J, Crowley, P.B.
登録日2023-11-08
公開日2024-03-06
実験手法X-RAY DIFFRACTION (1.71 Å)
主引用文献Multivalent Calixarene Complexation of a Designed Pentameric Lectin.
Biomacromolecules, 25, 2024
6H9T
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BU of 6h9t by Molmil
MamM CTD H285D - Cadmium form
分子名称: BETA-MERCAPTOETHANOL, CADMIUM ION, Magnetosome protein MamM, ...
著者Barber-Zucker, S, Zarivach, R.
登録日2018-08-06
公開日2019-08-21
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (1.7 Å)
主引用文献MamM CTD H285D - Cadmium form
To Be Published
6H9Y
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BU of 6h9y by Molmil
Unraveling the role of the secretor antigen in human rotavirus attachment to histo-blood group antigens
分子名称: 2-[BIS-(2-HYDROXY-ETHYL)-AMINO]-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, Outer capsid protein VP4, beta-D-galactopyranose-(1-3)-2-acetamido-2-deoxy-beta-D-glucopyranose
著者Ciges-Tomas, J.R, Gozalbo-Rovira, R, Vila-Vicent, S, Buesa, J, Santiso-Bellon, C, Monedero, V, Yebra, M.J, Rodriguez-Diaz, J, Marina, A.
登録日2018-08-06
公開日2019-06-12
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (1.31 Å)
主引用文献Unraveling the role of the secretor antigen in human rotavirus attachment to histo-blood group antigens.
Plos Pathog., 15, 2019

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件を2024-11-06に公開中

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