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7X6F
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BU of 7x6f by Molmil
Outer membrane lipoprotein QseG of Escherichia coli O157:H7
分子名称: 1,2-ETHANEDIOL, ACETATE ION, CITRATE ANION, ...
著者Matsumoto, K, Fukuda, Y, Inoue, T.
登録日2022-03-07
公開日2023-03-15
最終更新日2024-11-13
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Crystal structures of QseE and QseG: elements of a three-component system from Escherichia coli.
Acta Crystallogr.,Sect.F, 79, 2023
6EKS
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BU of 6eks by Molmil
Vibrio cholerae neuraminidase complexed with oseltamivir carboxylate
分子名称: (3R,4R,5S)-4-(acetylamino)-5-amino-3-(pentan-3-yloxy)cyclohex-1-ene-1-carboxylic acid, CALCIUM ION, GLYCEROL, ...
著者Schuetz, A, Heinemann, U.
登録日2017-09-27
公開日2017-11-29
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (1.87 Å)
主引用文献Different Inhibitory Potencies of Oseltamivir Carboxylate, Zanamivir, and Several Tannins on Bacterial and Viral Neuraminidases as Assessed in a Cell-Free Fluorescence-Based Enzyme Inhibition Assay.
Molecules, 22, 2017
7MJP
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BU of 7mjp by Molmil
Vascular KATP channel: Kir6.1 SUR2B propeller-like conformation 2
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, 5-chloro-N-(2-{4-[(cyclohexylcarbamoyl)sulfamoyl]phenyl}ethyl)-2-methoxybenzamide, ADENOSINE-5'-TRIPHOSPHATE, ...
著者Sung, M.W, Shyng, S.L.
登録日2021-04-20
公開日2021-10-13
最終更新日2024-05-29
実験手法ELECTRON MICROSCOPY (4.2 Å)
主引用文献Vascular K ATP channel structural dynamics reveal regulatory mechanism by Mg-nucleotides.
Proc.Natl.Acad.Sci.USA, 118, 2021
7EIG
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BU of 7eig by Molmil
BRD4-BD1 in complex with LT-730-903
分子名称: 1-[5-(5-azanyl-1H-benzimidazol-2-yl)-2-methyl-4-phenyl-1H-pyrrol-3-yl]ethanone, Bromodomain-containing protein 4
著者Zheng, W, Kong, B, Tang, W, Zhu, J, Chen, Y.
登録日2021-03-31
公開日2022-04-06
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (1.3 Å)
主引用文献BRD4-BD1 in complex with LT-730-903
To Be Published
9Q8F
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BU of 9q8f by Molmil
Structure of the (6-4) photolyase of Caulobacter crescentus with K48A mutation in its dark adapted and oxidized state determined by synchrotron
分子名称: 1-deoxy-1-(6,7-dimethyl-2,4-dioxo-3,4-dihydropteridin-8(2H)-yl)-D-ribitol, CHLORIDE ION, Cryptochrome/photolyase family protein, ...
著者Po Hsun, W, Maestre-Reyna, M, Essen, L.-O.
登録日2025-02-24
公開日2025-05-07
最終更新日2025-05-21
実験手法X-RAY DIFFRACTION (1.5 Å)
主引用文献Redox-State-Dependent Structural Changes within a Prokaryotic 6-4 Photolyase.
J.Am.Chem.Soc., 147, 2025
7X4W
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Crystal structure of Keap1 BTB domain in complex with dimethyl fumarate (DMF)
分子名称: Dimethyl fumarate, Kelch-like ECH-associated protein 1
著者Qu, L.Z.
登録日2022-03-03
公開日2023-03-08
最終更新日2024-10-23
実験手法X-RAY DIFFRACTION (3.209 Å)
主引用文献Characterization of the modification of Kelch-like ECH-associated protein 1 by different fumarates.
Biochem.Biophys.Res.Commun., 605, 2022
5K9G
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BU of 5k9g by Molmil
Crystal Structure of GTP Cyclohydrolase-IB with Tris
分子名称: 1,2-ETHANEDIOL, 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, FORMIC ACID, ...
著者Alvarez, J, Stec, B, Swairjo, M.A.
登録日2016-05-31
公開日2016-09-07
最終更新日2024-11-06
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Mechanism and catalytic strategy of the prokaryotic-specific GTP cyclohydrolase-IB.
Biochem.J., 474, 2017
7TRO
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BU of 7tro by Molmil
Crystal structure of R14A-R20A human Galectin-7 mutant in presence of lactose
分子名称: 1,2-ETHANEDIOL, 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, Galectin-7, ...
著者Pham, N.T.H, Calmettes, C, Doucet, N.
登録日2022-01-29
公開日2023-02-01
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Crystal structure of R14A-R20A human Galectin-7 mutant in presence of lactose
To Be Published
6YI5
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BU of 6yi5 by Molmil
In-situ structure of the trimeric HEF from influenza C by flexible fitting into a cryo-ET map.
分子名称: Hemagglutinin-esterase-fusion glycoprotein, beta-D-mannopyranose-(1-4)-2-acetamido-2-deoxy-alpha-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, beta-D-mannopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose
著者Halldorsson, S, Rosenthal, P.B.
登録日2020-03-31
公開日2021-03-24
最終更新日2024-10-16
実験手法ELECTRON MICROSCOPY (9.1 Å)
主引用文献In situ structure and organization of the influenza C virus surface glycoprotein.
Nat Commun, 12, 2021
6EOY
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BU of 6eoy by Molmil
Transthyretin in complex with 4-(1,3-Benzothiazol-2-yl)-2-methylaniline
分子名称: 4-(1,3-benzothiazol-2-yl)-2-methyl-aniline, Transthyretin
著者Leite, J.P, Gales, L.
登録日2017-10-10
公開日2021-10-06
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (1.38 Å)
主引用文献Targeting transthyretin in Alzheimer's disease: Drug discovery of small-molecule chaperones as disease-modifying drug candidates for Alzheimer's disease.
Eur.J.Med.Chem., 226, 2021
1P82
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BU of 1p82 by Molmil
NMR STRUCTURE OF 1-25 FRAGMENT OF MYCOBACTERIUM TUBERCULOSIS CPN10
分子名称: 10 kDa chaperonin
著者Ciutti, A, Spiga, O, Giannozzi, E, Scarselli, M, Di Maro, D, Calamandrei, D, Niccolai, N, Bernini, A.
登録日2003-05-06
公開日2003-05-27
最終更新日2024-05-22
実験手法SOLUTION NMR
主引用文献Solution Structure of 1-25 fragment of Cpn10 from Mycobacterium Tuberculosis
To be Published
9EZ4
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BU of 9ez4 by Molmil
Complex of a mutant of the SARS-CoV-2 main protease Mpro with the nsp5/6 substrate peptide.
分子名称: 1,2-ETHANEDIOL, DI(HYDROXYETHYL)ETHER, GLUTAMINE, ...
著者Battistutta, R, Fornasier, E, Giachin, G.
登録日2024-04-10
公開日2025-02-12
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Allostery in homodimeric SARS-CoV-2 main protease.
Commun Biol, 7, 2024
6TMC
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BU of 6tmc by Molmil
VIM-2_1dh-Triazole inhibitors with promising inhibitor effects against antibiotic resistance metallo-beta-lactamases
分子名称: 4-[2-(phenylsulfonyl)ethyl]-5-(propan-2-yloxymethyl)-1~{H}-1,2,3-triazole, Beta-lactamase class B VIM-2, HYDROXIDE ION, ...
著者Leiros, H.-K.S, Christopeit, T.
登録日2019-12-04
公開日2020-07-22
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (1.4 Å)
主引用文献Structural studies of triazole inhibitors with promising inhibitor effects against antibiotic resistance metallo-beta-lactamases.
Bioorg.Med.Chem., 28, 2020
6KSF
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BU of 6ksf by Molmil
Crystal Structure of ALKBH1 bound to 21-mer DNA bulge
分子名称: Alpha-ketoglutarate-dependent dioxygenase alkB homolog 1, CHLORIDE ION, DNA (5'-D(*DGP*DCP*DTP*DGP*DAP*DGP*DTP*DGP*DCP*DCP*DCP*DGP*DCP*DGP*DTP*DGP*DCP*DTP*DGP*DGP*DAP*DTP*DCP*DC)-3'), ...
著者Li, H, Zhang, M.
登録日2019-08-23
公開日2020-04-08
最終更新日2024-10-23
実験手法X-RAY DIFFRACTION (2.4 Å)
主引用文献Mammalian ALKBH1 serves as an N6-mA demethylase of unpairing DNA.
Cell Res., 30, 2020
5DSP
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BU of 5dsp by Molmil
Structure of CO2 released apo-form of human carbonic anhydrase II with 40 sec warming
分子名称: Carbonic anhydrase 2, GLYCEROL
著者Kim, C.U, Park, S.Y, McKenna, R.
登録日2015-09-17
公開日2016-05-04
最終更新日2023-11-08
実験手法X-RAY DIFFRACTION (1.4 Å)
主引用文献Tracking solvent and protein movement during CO2 release in carbonic anhydrase II crystals
Proc. Natl. Acad. Sci. U.S.A., 113, 2016
7X0T
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BU of 7x0t by Molmil
Cryo-EM structure of human ABCD1 E630Q in the presence of C26:0-CoA and ATP
分子名称: ADENOSINE-5'-TRIPHOSPHATE, ATP-binding cassette sub-family D member 1, OCTANOYL-COENZYME A
著者Chao, X, Li-Na, J, Lin, T.
登録日2022-02-22
公開日2023-03-22
最終更新日2024-06-26
実験手法ELECTRON MICROSCOPY (3.3 Å)
主引用文献Structural insights into substrate recognition and translocation of human peroxisomal ABC transporter ALDP.
Signal Transduct Target Ther, 8, 2023
7MXH
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BU of 7mxh by Molmil
CD1c with antigen analogue 3
分子名称: (2S)-2,3-dihydroxypropyl hexadecanoate, 2,6-anhydro-1-deoxy-1,1-difluoro-1-[(R)-hydroxy{[(4S,8S,12S,16S,20S)-4,8,12,16,20-pentamethylheptacosyl]oxy}phosphoryl]-D-glycero-D-galacto-heptitol, 2-acetamido-2-deoxy-beta-D-glucopyranose, ...
著者Cao, T.P, Shahine, A, Rossjohn, J.
登録日2021-05-19
公開日2021-11-17
最終更新日2024-11-13
実験手法X-RAY DIFFRACTION (2.11 Å)
主引用文献Rational design of a hydrolysis-resistant mycobacterial phosphoglycolipid antigen presented by CD1c to T cells.
J.Biol.Chem., 297, 2021
4ZGY
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BU of 4zgy by Molmil
STRUCTURE of HUMAN ORNITHINE DECARBOXYLASE IN COMPLEX WITH A C-TERMINAL FRAGMENT OF ANTIZYME
分子名称: MAGNESIUM ION, Ornithine decarboxylase, Ornithine decarboxylase antizyme 1, ...
著者Wu, H.Y, Chan, N.L.
登録日2015-04-24
公開日2015-09-02
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (2.63 Å)
主引用文献Structural basis of antizyme-mediated regulation of polyamine homeostasis
Proc.Natl.Acad.Sci.USA, 112, 2015
7XNV
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BU of 7xnv by Molmil
Structurally hetero-junctional human Cx36/GJD2 gap junction channel in soybean lipids (C6 symmetry)
分子名称: 1,2-DIMYRISTOYL-RAC-GLYCERO-3-PHOSPHOCHOLINE, Gap junction delta-2 protein
著者Lee, S.N, Cho, H.J, Jeong, H, Ryu, B, Lee, H.J, Lee, H.H, Woo, J.S.
登録日2022-04-29
公開日2023-03-22
最終更新日2025-07-02
実験手法ELECTRON MICROSCOPY (3.4 Å)
主引用文献Cryo-EM structures of human Cx36/GJD2 neuronal gap junction channel.
Nat Commun, 14, 2023
5KF9
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BU of 5kf9 by Molmil
X-ray structure of a glucosamine N-Acetyltransferase from Clostridium acetobutylicum in complex with N-acetylglucosamine
分子名称: 1,2-ETHANEDIOL, 2-acetamido-2-deoxy-beta-D-glucopyranose, 3-[4-(2-HYDROXYETHYL)PIPERAZIN-1-YL]PROPANE-1-SULFONIC ACID, ...
著者Dopkins, B.J, Thoden, J.B, Holden, H.M, Tipton, P.A.
登録日2016-06-12
公開日2016-07-06
最終更新日2023-09-27
実験手法X-RAY DIFFRACTION (1.49 Å)
主引用文献Structural Studies on a Glucosamine/Glucosaminide N-Acetyltransferase.
Biochemistry, 55, 2016
5XLY
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BU of 5xly by Molmil
Crystal structure of CheR1 in complex with c-di-GMP-bound MapZ
分子名称: 9,9'-[(2R,3R,3aS,5S,7aR,9R,10R,10aS,12S,14aR)-3,5,10,12-tetrahydroxy-5,12-dioxidooctahydro-2H,7H-difuro[3,2-d:3',2'-j][1,3,7,9,2,8]tetraoxadiphosphacyclododecine-2,9-diyl]bis(2-amino-1,9-dihydro-6H-purin-6-one), Chemotaxis protein methyltransferase 1, Cyclic diguanosine monophosphate-binding protein PA4608
著者Yuan, Z, Zhu, Y, Gu, L.
登録日2017-05-12
公開日2017-08-23
最終更新日2024-03-27
実験手法X-RAY DIFFRACTION (1.763 Å)
主引用文献Structural basis for the regulation of chemotaxis by MapZ in the presence of c-di-GMP
Acta Crystallogr D Struct Biol, 73, 2017
9EY9
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BU of 9ey9 by Molmil
Yeast 20S proteasome in complex with a sybactin derivative (PheSyr)
分子名称: MAGNESIUM ION, Probable proteasome subunit alpha type-7, Proteasome subunit alpha type-1, ...
著者Praeve, L, Kuttenlochner, W, Tabak, W.W.A, Langer, C, Kaiser, M, Groll, M, Bode, H.B.
登録日2024-04-09
公開日2025-02-19
実験手法X-RAY DIFFRACTION (3.1 Å)
主引用文献Bioengineering of syrbactin megasynthetases for immunoproteasome inhibitor production
Chem, 10, 2024
7X07
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BU of 7x07 by Molmil
Cryo-EM structure of human ABCD1 in the presence of C26:0
分子名称: ATP-binding cassette sub-family D member 1, hexacosanoic acid
著者Chao, X, Li-Na, J, Lin, T.
登録日2022-02-21
公開日2023-03-22
最終更新日2025-07-02
実験手法ELECTRON MICROSCOPY (3.78 Å)
主引用文献Structural insights into substrate recognition and translocation of human peroxisomal ABC transporter ALDP.
Signal Transduct Target Ther, 8, 2023
6AKQ
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The PDZ tandem fragment of A. aeolicus S2P homolog with the PA12 tag inserted between the residues 263 and 267
分子名称: PDZ tandem fragment of A. aeolicus site-2 protease homolog with the PA tag insertion
著者Tamura, R, Oi, R, Kaneko, M.K, Kato, Y, Nogi, T.
登録日2018-09-03
公開日2019-02-13
最終更新日2024-11-13
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Application of the NZ-1 Fab as a crystallization chaperone for PA tag-inserted target proteins.
Protein Sci., 28, 2019
5U4L
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RTA-V1C7_G29R-high-salt
分子名称: 1,2-ETHANEDIOL, CHLORIDE ION, PHOSPHATE ION, ...
著者Rudolph, M.J, Mantis, N.
登録日2016-12-05
公開日2017-12-13
最終更新日2024-11-20
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Using homology modeling to interrogate binding affinity in neutralization of ricin toxin by a family of single domain antibodies.
Proteins, 85, 2017

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