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6JMK
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BU of 6jmk by Molmil
Ribosomal protein S7 from Mycobacterium tuberculosis
分子名称: 1,2-ETHANEDIOL, 30S ribosomal protein S7, GLYCEROL
著者Li, Z, Li, J.
登録日2019-03-11
公開日2019-03-20
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Structural insights into the complex of trigger factor chaperone and ribosomal protein S7 from Mycobacterium tuberculosis.
Biochem. Biophys. Res. Commun., 512, 2019
5LLC
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BU of 5llc by Molmil
Crystal structure of human carbonic anhydrase isozyme II with 3-(Methylamino)-2,5,6-trifluoro-4-[(2-phenylethyl)sulfonyl]benzenesulfonamide
分子名称: 1,2-ETHANEDIOL, 2,3,6-tris(fluoranyl)-5-(methylamino)-4-(2-phenylethylsulfonyl)benzenesulfonamide, Carbonic anhydrase 2, ...
著者Manakova, E, Smirnov, A, Grazulis, S.
登録日2016-07-27
公開日2017-08-16
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (1.1 Å)
主引用文献Crystal structure correlations with the intrinsic thermodynamics of human carbonic anhydrase inhibitor binding.
PeerJ, 6, 2018
5AXU
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BU of 5axu by Molmil
Crystal Structure of Cypovirus Polyhedra R13A Mutant
分子名称: 1,2-ETHANEDIOL, ADENOSINE-5'-TRIPHOSPHATE, CYTIDINE-5'-TRIPHOSPHATE, ...
著者Abe, S, Ijiri, H, Negishi, H, Yamanaka, H, Sasaki, K, Hirata, K, Mori, H, Ueno, T.
登録日2015-08-01
公開日2015-11-11
最終更新日2024-11-20
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献Design of Enzyme-Encapsulated Protein Containers by In Vivo Crystal Engineering
Adv. Mater. Weinheim, 27, 2015
6Q62
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BU of 6q62 by Molmil
Xanthomonas albilineans Dihydropteroate synthase in complex with (indole-2-carboxylic acid) and (6-chloroguanine)
分子名称: 1,2-ETHANEDIOL, 1H-indole-2-carboxylic acid, 6-chloroguanine, ...
著者Oliveira, A.A, Hyvonen, M, Guido, R.V.C.
登録日2018-12-10
公開日2020-01-15
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (1.5 Å)
主引用文献Xanthomonas albilineans Dihydropteroate synthase in complex with (indole-2-carboxylic acid) and (6-chloroguanine)
To Be Published
6JIW
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BU of 6jiw by Molmil
Crystal structure of S. aureus CntK with C72S mutation
分子名称: 1,2-ETHANEDIOL, Diaminopimelate epimerase, SULFATE ION
著者Luo, S, Ju, Y, Zhou, H.
登録日2019-02-23
公開日2019-10-16
最終更新日2024-10-09
実験手法X-RAY DIFFRACTION (1.58 Å)
主引用文献Crystal structure of CntK, the cofactor-independent histidine racemase in staphylopine-mediated metal acquisition of Staphylococcus aureus.
Int.J.Biol.Macromol., 135, 2019
5BXA
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BU of 5bxa by Molmil
Structure of PslG from Pseudomonas aeruginosa in complex with mannose
分子名称: 1,2-ETHANEDIOL, CADMIUM ION, CHLORIDE ION, ...
著者Baker, P, Little, D.J, Howell, P.L.
登録日2015-06-08
公開日2015-10-07
最終更新日2023-09-27
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Characterization of the Pseudomonas aeruginosa Glycoside Hydrolase PslG Reveals That Its Levels Are Critical for Psl Polysaccharide Biosynthesis and Biofilm Formation.
J.Biol.Chem., 290, 2015
6JV0
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BU of 6jv0 by Molmil
Crystal Structure of N-terminal domain of ArgZ, bound to Product, an arginine dihydrolase from the Ornithine-Ammonia Cycle in Cyanobacteria
分子名称: 1,2-ETHANEDIOL, L-ornithine, Sll1336 protein
著者Zhuang, N, Li, L, Wu, X, Zhang, Y.
登録日2019-04-15
公開日2020-01-15
最終更新日2024-03-27
実験手法X-RAY DIFFRACTION (1.14 Å)
主引用文献Crystal structures and biochemical analyses of the bacterial arginine dihydrolase ArgZ suggests a "bond rotation" catalytic mechanism.
J.Biol.Chem., 295, 2020
5CLH
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BU of 5clh by Molmil
Structure of PurE (N5-carboxyaminoimidazole ribonucleotide mutase) H59N from the acidophilic bacterium Acetobacter aceti, at pH 8
分子名称: 1,2-ETHANEDIOL, ACETATE ION, N5-carboxyaminoimidazole ribonucleotide mutase, ...
著者Starks, C.M, Kappock, T.J.
登録日2015-07-16
公開日2016-07-27
最終更新日2023-09-27
実験手法X-RAY DIFFRACTION (1.75 Å)
主引用文献Structure of a single tryptophan mutant of Acetobacter aceti PurE
To Be Published
5BZD
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BU of 5bzd by Molmil
Crystal Structure of PCDN-27A, an antibody from the PCDN family of HIV-1 antibodies
分子名称: 5G8 HIV Antibody heavy chain, 5G8 HIV Antibody light chain, GLYCEROL
著者Garces, F, WILSON, I.A.
登録日2015-06-11
公開日2016-05-25
最終更新日2024-11-20
実験手法X-RAY DIFFRACTION (2.7 Å)
主引用文献Early Antibody Lineage Diversification and Independent Limb Maturation Lead to Broad HIV-1 Neutralization Targeting the Env High-Mannose Patch
Immunity, 44, 2016
5BX9
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BU of 5bx9 by Molmil
Structure of PslG from Pseudomonas aeruginosa
分子名称: 1,2-ETHANEDIOL, CADMIUM ION, CHLORIDE ION, ...
著者Baker, P, Little, D.J, Howell, P.L.
登録日2015-06-08
公開日2015-10-07
最終更新日2024-03-06
実験手法X-RAY DIFFRACTION (2.001 Å)
主引用文献Characterization of the Pseudomonas aeruginosa Glycoside Hydrolase PslG Reveals That Its Levels Are Critical for Psl Polysaccharide Biosynthesis and Biofilm Formation.
J.Biol.Chem., 290, 2015
5C4Y
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BU of 5c4y by Molmil
Crystal structure of putative TetR family transcription factor from Listeria monocytogenes
分子名称: 1,2-ETHANEDIOL, Putative transcription regulator Lmo0852
著者Chang, C, Tesar, C, Clancy, S, Joachimiak, A, Midwest Center for Structural Genomics (MCSG)
登録日2015-06-18
公開日2015-07-08
最終更新日2024-10-23
実験手法X-RAY DIFFRACTION (1.77 Å)
主引用文献Crystal structure of putative TetR family transcription factor from Listeria monocytogenes
to be published
3GVN
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BU of 3gvn by Molmil
The 1.2 Angstroem crystal structure of an E.coli tRNASer acceptor stem microhelix reveals two magnesium binding sites
分子名称: 5'-R(*CP*CP*UP*CP*AP*CP*C)-3', 5'-R(*GP*GP*UP*GP*AP*GP*G)-3', MAGNESIUM ION
著者Eichert, A, Furste, J.P, Schreiber, A, Perbandt, M, Betzel, C, Erdmann, V.A, Forster, C.
登録日2009-03-31
公開日2009-07-28
最終更新日2023-11-01
実験手法X-RAY DIFFRACTION (1.2 Å)
主引用文献The 1.2A crystal structure of an E. coli tRNASer)acceptor stem microhelix reveals two magnesium binding sites.
Biochem.Biophys.Res.Commun., 386, 2009
1D39
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BU of 1d39 by Molmil
COVALENT MODIFICATION OF GUANINE BASES IN DOUBLE STRANDED DNA: THE 1.2 ANGSTROMS Z-DNA STRUCTURE OF D(CGCGCG) IN THE PRESENCE OF CUCL2
分子名称: COPPER (II) ION, DNA (5'-D(*CP*(CU)GP*CP*(CU)GP*CP*(CU)G)-3'), SODIUM ION
著者Kagawa, T.F, Geierstanger, B.H, Wang, A.H.-J, Ho, P.S.
登録日1991-05-07
公開日1992-04-15
最終更新日2024-04-03
実験手法X-RAY DIFFRACTION (1.2 Å)
主引用文献Covalent modification of guanine bases in double-stranded DNA. The 1.2-A Z-DNA structure of d(CGCGCG) in the presence of CuCl2.
J.Biol.Chem., 266, 1991
9D0H
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BU of 9d0h by Molmil
Crystal structure of the wild-type Thermus thermophilus 70S ribosome in complex with C-cresomycin, mRNA, deacylated A-site tRNAphe, aminoacylated P-site fMet-tRNAmet, and deacylated E-site tRNAphe at 2.50A resolution
分子名称: (4S,5aS,8S,8aR)-4-(2-methylpropyl)-N-[(1R,2R,3R,4Z,9R,10R,11R,12R)-10,11,12-trihydroxy-3-methyl-13-oxabicyclo[7.3.1]tridec-4-en-2-yl]octahydro-2H-oxepino[2,3-c]pyrrole-8-carboxamide, 16S Ribosomal RNA, 23S Ribosomal RNA, ...
著者Aleksandrova, E.V, Wu, K.J.Y, Robinson, P.J, Benedetto, A.E, Yu, M, Tresco, B.I.C, See, D.N.Y, Jiang, T, Ramkissoon, A, Dunand, C.F, Svetlov, M.S, Lee, J, Myers, A.G, Polikanov, Y.S.
登録日2024-08-07
公開日2025-08-27
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Why Sulfur is Important in Lincosamide Antibiotics.
Chem, 11, 2025
9R3C
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BU of 9r3c by Molmil
Recombinant human butyrylcholinesterase in complex with N-([(3S)-1-benzylpiperidin-3-yl]methyl)-N-(2-methoxyethyl)naphthalene-2-sulfonamide
分子名称: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-[alpha-L-fucopyranose-(1-6)]2-acetamido-2-deoxy-beta-D-glucopyranose, ...
著者Brazzolotto, X, Kosak, U, Gobec, S, Nachon, F.
登録日2025-05-03
公開日2025-07-30
最終更新日2025-08-06
実験手法X-RAY DIFFRACTION (2.31 Å)
主引用文献Chiral switch of a butyrylcholinesterase inhibitor for the treatment of Alzheimer's disease.
Chem.Biol.Interact., 420, 2025
7R7K
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BU of 7r7k by Molmil
Structure of Human Anaplastic Lymphoma Kinase Domain in complex with (4-[6-amino-5-[(1~{R})-1-[5-fluoro-2-(triazol-2-yl)phenyl]ethoxy]-3-pyridyl]isoindolin-1-one)
分子名称: 4-(6-amino-5-{(1R)-1-[5-fluoro-2-(2H-1,2,3-triazol-2-yl)phenyl]ethoxy}pyridin-3-yl)-2,3-dihydro-1H-isoindol-1-one, ALK tyrosine kinase receptor
著者McTigue, M.
登録日2021-06-24
公開日2022-06-29
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (1.831 Å)
主引用文献Analysis of lorlatinib analogs reveals a roadmap for targeting diverse compound resistance mutations in ALK-positive lung cancer.
Nat Cancer, 3, 2022
5FWD
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BU of 5fwd by Molmil
Crystal Structure of Mus musculus Protein Arginine Methyltransferase 2 with CP2
分子名称: 1,2-ETHANEDIOL, 9-(7-{[amino(iminio)methyl]amino}-5,6,7-trideoxy-beta-D-ribo-heptofuranosyl)-9H-purin-6-amine, CALCIUM ION, ...
著者Cura, V, Troffer-Charlier, N, Marechal, N, Bonnefond, L, Cavarelli, J.
登録日2016-02-12
公開日2017-03-01
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Structural Studies of Protein Arginine Methyltransferase 2 Reveal its Interactions with Potential Substrates and Inhibitors.
FEBS J., 284, 2017
3HP9
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BU of 3hp9 by Molmil
Crystal structure of SSB/Exonuclease I in complex with inhibitor CFAM
分子名称: 1,2-ETHANEDIOL, 2-{[2-chloro-5-(trifluoromethyl)phenyl]amino}-5-methoxybenzoic acid, DIMETHYL SULFOXIDE, ...
著者Satyshur, K.A.
登録日2009-06-03
公開日2010-01-19
最終更新日2023-09-06
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献Small-molecule tools for dissecting the roles of SSB/protein interactions in genome maintenance
Proc.Natl.Acad.Sci.USA, 107, 2010
9MIH
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BU of 9mih by Molmil
273-4D01 Fab in complex with HIV-1 BG505 SOSIP Env trimer and RM20A3 Fab
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, 273-4D01 heavy chain Fv, ...
著者Phulera, S, Ozorowski, G, Ward, A.B.
登録日2024-12-12
公開日2025-05-21
最終更新日2025-08-13
実験手法ELECTRON MICROSCOPY (3.9 Å)
主引用文献Precise targeting of HIV broadly neutralizing antibody precursors in humans.
Science, 389, 2025
6TG1
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BU of 6tg1 by Molmil
Crystal Structure of EGFR T790M/V948R in Complex with Covalent Pyrrolopyrimidine 21b
分子名称: 1,2-ETHANEDIOL, Epidermal growth factor receptor, SODIUM ION, ...
著者Niggenaber, J, Mueller, M.P, Rauh, D.
登録日2019-11-14
公開日2020-09-30
最終更新日2024-10-23
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献Targeting Her2-insYVMA with Covalent Inhibitors-A Focused Compound Screening and Structure-Based Design Approach.
J.Med.Chem., 63, 2020
9R3B
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BU of 9r3b by Molmil
Recombinant human Butyrylcholinesterase in complex with N-([(3R)-1-benzylpiperidin-3-yl]methyl)-N-(2-methoxyethyl)naphthalene-2-sulfonamide
分子名称: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-[alpha-L-fucopyranose-(1-6)]2-acetamido-2-deoxy-beta-D-glucopyranose, ...
著者Brazzolotto, X, Kosac, U, Gobec, S, Nachon, F.
登録日2025-05-03
公開日2025-07-30
最終更新日2025-08-06
実験手法X-RAY DIFFRACTION (2.15 Å)
主引用文献Chiral switch of a butyrylcholinesterase inhibitor for the treatment of Alzheimer's disease.
Chem.Biol.Interact., 420, 2025
8HS6
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BU of 8hs6 by Molmil
Brucella melitensis 7-alpha-Hydroxysteroid Dehydrogenase mutant:1-53 truncation
分子名称: 7-alpha-hydroxysteroid dehydrogenase
著者Liu, Z.Y, Zhang, R.Z.
登録日2022-12-17
公開日2024-01-03
実験手法X-RAY DIFFRACTION (2.35 Å)
主引用文献Structure of 7-alpha-hydroxysteroid dehydrogenase
To Be Published
8TP7
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BU of 8tp7 by Molmil
H2 hemagglutinin (A/Singapore/1/1957) in complex with Sa-targeting Fab 4-1-1G03
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-[alpha-L-fucopyranose-(1-6)]2-acetamido-2-deoxy-beta-D-glucopyranose, Heavy chain of monoclonal antibody 4-1-1G03, ...
著者Yang, Y.R, Han, J, Perrett, H.R, Ward, A.B.
登録日2023-08-04
公開日2023-10-11
最終更新日2025-02-26
実験手法ELECTRON MICROSCOPY (2.8 Å)
主引用文献Immune memory shapes human polyclonal antibody responses to H2N2 vaccination.
Cell Rep, 43, 2024
8KCT
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BU of 8kct by Molmil
Cryo-EM structure of human gamma-secretase in complex with Nirogacestat
分子名称: 1,2-DIACYL-SN-GLYCERO-3-PHOSPHOCHOLINE, 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, ...
著者Guo, X, Li, H, Kai, U, Yan, C, Lei, J, Zhou, R, Shi, Y.
登録日2023-08-08
公開日2024-08-14
最終更新日2025-07-23
実験手法ELECTRON MICROSCOPY (2.6 Å)
主引用文献Structural basis of human gamma-secretase inhibition by anticancer clinical compounds.
Nat.Struct.Mol.Biol., 32, 2025
8KCS
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BU of 8kcs by Molmil
Cryo-EM structure of human gamma-secretase in complex with BMS906024
分子名称: 1,2-DIACYL-SN-GLYCERO-3-PHOSPHOCHOLINE, 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, ...
著者Guo, X, Li, H, Kai, U, Yan, C, Lei, J, Zhou, R, Shi, Y.
登録日2023-08-08
公開日2024-08-14
最終更新日2025-07-23
実験手法ELECTRON MICROSCOPY (2.4 Å)
主引用文献Structural basis of human gamma-secretase inhibition by anticancer clinical compounds.
Nat.Struct.Mol.Biol., 32, 2025

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