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7QVE
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BU of 7qve by Molmil
Spinach 20S proteasome
分子名称: Proteasome subunit alpha type, Proteasome subunit alpha type-3, Proteasome subunit beta, ...
著者Kandolf, S, Grishkovskaya, I, Meinhart, A, Haselbach, D.
登録日2022-01-21
公開日2022-05-25
最終更新日2024-07-17
実験手法ELECTRON MICROSCOPY (3.3 Å)
主引用文献Cryo-EM structure of the plant 26S proteasome.
Plant Commun., 3, 2022
6ONY
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BU of 6ony by Molmil
BRD2_Bromodomain1 complex with inhibitor 744
分子名称: 1,2-ETHANEDIOL, Bromodomain-containing protein 2, N-ethyl-4-[2-(4-fluoro-2,6-dimethylphenoxy)-5-(2-hydroxypropan-2-yl)phenyl]-6-methyl-7-oxo-6,7-dihydro-1H-pyrrolo[2,3-c]pyridine-2-carboxamide
著者Longenecker, K.L, Bigelow, L.
登録日2019-04-22
公開日2020-01-29
最終更新日2024-03-13
実験手法X-RAY DIFFRACTION (1.98 Å)
主引用文献Selective inhibition of the BD2 bromodomain of BET proteins in prostate cancer.
Nature, 578, 2020
7KL1
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BU of 7kl1 by Molmil
Cocrystal structure of human CaMKII-alpha (CAMK2A)kinase domain and GluN2B(S1303D)
分子名称: 1,2-ETHANEDIOL, ADENOSINE-5'-TRIPHOSPHATE, Calcium/calmodulin-dependent protein kinase type II subunit alpha, ...
著者Ozden, C, Stratton, M.M, Garman, S.C.
登録日2020-10-28
公開日2020-12-23
最終更新日2024-12-25
実験手法X-RAY DIFFRACTION (2.4 Å)
主引用文献CaMKII binds both substrates and activators at the active site.
Cell Rep, 40, 2022
7KMI
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BU of 7kmi by Molmil
LY-CoV481 neutralizing antibody against SARS-CoV-2
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, GLYCEROL, LY-CoV481 Fab heavy chain, ...
著者Hendle, J, Pustilnik, A, Sauder, J.M, Coleman, K.A, Boyles, J.S, Dickinson, C.D.
登録日2020-11-02
公開日2021-01-27
最終更新日2024-11-06
実験手法X-RAY DIFFRACTION (1.73 Å)
主引用文献The neutralizing antibody, LY-CoV555, protects against SARS-CoV-2 infection in nonhuman primates.
Sci Transl Med, 13, 2021
7QVH
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BU of 7qvh by Molmil
The crystal structure of HotPETase, an evolved thermostable variant of IsPETase
分子名称: Poly(ethylene terephthalate) hydrolase, TRIETHYLENE GLYCOL
著者Hardy, F.J, Levy, C, Green, A.P.
登録日2022-01-21
公開日2022-08-03
最終更新日2024-11-06
実験手法X-RAY DIFFRACTION (2.24 Å)
主引用文献Directed evolution of an efficient and thermostable PET depolymerase
Nat Catal, 2022
5HGC
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BU of 5hgc by Molmil
A Serpin structure
分子名称: (11alpha,14beta)-11,17,21-trihydroxypregn-4-ene-3,20-dione, 2,6-diamino-2,6-dideoxy-alpha-D-glucopyranose, SULFATE ION, ...
著者Das, S, Vashchenko, G.V, Van Petegem, F.
登録日2016-01-08
公開日2016-04-06
最終更新日2023-09-27
実験手法X-RAY DIFFRACTION (2.43 Å)
主引用文献A Serpin structure
J.Biol.Chem., 2016
1LCE
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BU of 1lce by Molmil
LACTOBACILLUS CASEI THYMIDYLATE SYNTHASE TERNARY COMPLEX WITH DUMP AND CH2THF
分子名称: 2'-DEOXYURIDINE 5'-MONOPHOSPHATE, 5,10-METHYLENE-6-HYDROFOLIC ACID, THYMIDYLATE SYNTHASE
著者Birdsall, D.L, Finer-Moore, J, Stroud, R.M.
登録日1995-06-22
公開日1995-10-15
最終更新日2024-02-14
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Refined structures of substrate-bound and phosphate-bound thymidylate synthase from Lactobacillus casei.
J.Mol.Biol., 232, 1993
5JA4
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BU of 5ja4 by Molmil
Crystal structure of human TONSL and MCM2 HBDs binding to a histone H3-H4 tetramer
分子名称: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, DNA replication licensing factor MCM2, GLYCEROL, ...
著者Huang, H, Patel, D.
登録日2016-04-11
公開日2016-06-15
最終更新日2023-09-27
実験手法X-RAY DIFFRACTION (2.424 Å)
主引用文献H4K20me0 marks post-replicative chromatin and recruits the TONSL-MMS22L DNA repair complex.
Nature, 534, 2016
5JCG
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BU of 5jcg by Molmil
Structure of Human Peroxiredoxin 3 as three stacked rings
分子名称: Thioredoxin-dependent peroxide reductase, mitochondrial
著者Yewdall, N.A, Gerrard, J.A, Goldstone, D.C.
登録日2016-04-15
公開日2016-05-25
最終更新日2023-09-27
実験手法X-RAY DIFFRACTION (2.8 Å)
主引用文献Structures of Human Peroxiredoxin 3 Suggest Self-Chaperoning Assembly that Maintains Catalytic State.
Structure, 24, 2016
7L3N
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BU of 7l3n by Molmil
SARS-CoV 2 Spike Protein bound to LY-CoV555
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, LY-CoV555 Fab heavy chain, ...
著者Goldsmith, J.A, McLellan, J.S.
登録日2020-12-18
公開日2021-02-03
最終更新日2024-10-23
実験手法ELECTRON MICROSCOPY (3.27 Å)
主引用文献LY-CoV555, a rapidly isolated potent neutralizing antibody, provides protection in a non-human primate model of SARS-CoV-2 infection.
Biorxiv, 2020
8SU9
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BU of 8su9 by Molmil
E. coli SIR2-HerA complex (hexamer HerA bound with dodecamer Sir2)
分子名称: ADENOSINE-5'-DIPHOSPHATE, MAGNESIUM ION, Nucleoside triphosphate hydrolase, ...
著者Shen, Z.F, Lin, Q.P, Fu, T.M.
登録日2023-05-11
公開日2024-03-27
実験手法ELECTRON MICROSCOPY (2.83 Å)
主引用文献Assembly-mediated activation of the SIR2-HerA supramolecular complex for anti-phage defense.
Mol.Cell, 83, 2023
8SUW
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BU of 8suw by Molmil
E. coli SIR2-HerA complex (dodecamer SIR2 bound 4 protomers of HerA)
分子名称: ADENOSINE-5'-DIPHOSPHATE, MAGNESIUM ION, Nucleoside triphosphate hydrolase, ...
著者Shen, Z.F, Lin, Q.P, Fu, T.M.
登録日2023-05-13
公開日2024-03-27
実験手法ELECTRON MICROSCOPY (3.15 Å)
主引用文献Assembly-mediated activation of the SIR2-HerA supramolecular complex for anti-phage defense.
Mol.Cell, 83, 2023
8SON
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BU of 8son by Molmil
Crystal structure of macrophage migration inhibitory factor in complex with N-[3-(Trifluoromethyl)phenyl]-3-(2-chloroanilino)-2-cyano-3-thioxopropanamide
分子名称: (2R)-3-[(2-chlorophenyl)amino]-2-cyano-3-thioxo-N-[3-(trifluoromethyl)phenyl]propanamide, GLYCEROL, Macrophage migration inhibitory factor, ...
著者Pantouris, G, Lolis, E.
登録日2023-04-28
公開日2024-05-22
最終更新日2025-06-04
実験手法X-RAY DIFFRACTION (1.63 Å)
主引用文献Inhibition of MIF with an Allosteric Inhibitor Triggers Cell Cycle Arrest in Acute Myeloid Leukemia.
Acs Omega, 10, 2025
8SCW
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BU of 8scw by Molmil
Crystal structure of IRAK4-HSA complexed with BMS-986147; 6-{5-CYANO-1H-PYRAZOLO[3,4-B]PYRIDIN-1-YL}-N-[(2R)-2-FLUORROXY-3-METHYLBUTYL]-4-[(PROPAN-2-YL)AMINO]PYRIDINE-3-CARBOXAMIDE
分子名称: (6M)-6-(5-cyano-1H-pyrazolo[3,4-b]pyridin-1-yl)-N-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-4-[(propan-2-yl)amino]pyridine-3-carboxamide, Interleukin-1 receptor-associated kinase 4, SULFATE ION
著者Muckelbauer, J.K, Ghosh, K.
登録日2023-04-05
公開日2025-02-12
実験手法X-RAY DIFFRACTION (2.76 Å)
主引用文献The Discovery of IRAK4 Inhibitor Clinical Candidates BMS-986126 and BMS-986147 for the Treatment of Autoimmune Diseases
To Be Published
8SCE
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BU of 8sce by Molmil
Crystal structure of IRAK4-HSA complexed with N-[(2R)-2-FLUORO-3-HYDROXY-3-METHYLBUTYL]-6-[(5-FLUOROPYRI-YL)AMINO]-4-[(PROPAN-2-YL)AMINO]PYRIDINE-3-CARBOXAMIDE
分子名称: Interleukin-1 receptor-associated kinase 4, N-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-6-[(5-fluoropyrimidin-4-yl)amino]-4-[(propan-2-yl)amino]pyridine-3-carboxamide, SULFATE ION
著者Muckelbauer, J.K, Ghosh, K.
登録日2023-04-05
公開日2025-02-12
実験手法X-RAY DIFFRACTION (1.89 Å)
主引用文献The Discovery of IRAK4 Inhibitor Clinical Candidates BMS-986126 and BMS-986147 for the Treatment of Autoimmune Diseases
To Be Published
8SCV
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BU of 8scv by Molmil
Crystal structure of IRAK4-HSA complexed with BMS-986126; 6-((5-CYANO-2-PYRIMIDINYL)AMINO)-N-((2R)-2-FLUORO-3-HYDROXHYLBUTYL)-4-(ISOPROPYLAMINO)NICOTINAMIDE
分子名称: 6-[(5-cyanopyrimidin-2-yl)amino]-N-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-4-[(propan-2-yl)amino]pyridine-3-carboxamide, Interleukin-1 receptor-associated kinase 4, SULFATE ION
著者Muckelbauer, J.K, Ghosh, K.
登録日2023-04-05
公開日2025-02-12
実験手法X-RAY DIFFRACTION (2.69 Å)
主引用文献The Discovery of IRAK4 Inhibitor Clinical Candidates BMS-986126 and BMS-986147 for the Treatment of Autoimmune Diseases
To Be Published
8TNF
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BU of 8tnf by Molmil
Crystal structure of sulfohexulose-1-phosphate aldolase from Paracoccus onubensis strain Merri
分子名称: DUF2090 domain-containing protein
著者Lee, M.
登録日2023-08-01
公開日2024-08-07
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献A patchwork pathway for catabolism degradation of the sulfosugar sulfofucose
To Be Published
8SXX
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BU of 8sxx by Molmil
E. coli dodecamer SIR2
分子名称: NICOTINAMIDE-ADENINE-DINUCLEOTIDE, SIR2-like domain-containing protein
著者Shen, Z.F, Lin, Q.P, Fu, T.M.
登録日2023-05-24
公開日2023-12-27
最終更新日2024-03-27
実験手法ELECTRON MICROSCOPY (3.6 Å)
主引用文献Assembly-mediated activation of the SIR2-HerA supramolecular complex for anti-phage defense.
Mol.Cell, 83, 2023
8SUB
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BU of 8sub by Molmil
E. coli SIR2-HerA complex (dodecamer SIR2 pentamer HerA)
分子名称: ADENOSINE-5'-DIPHOSPHATE, MAGNESIUM ION, Nucleoside triphosphate hydrolase, ...
著者Shen, Z.F, Lin, Q.P, Fu, T.M.
登録日2023-05-11
公開日2023-12-27
最終更新日2024-03-27
実験手法ELECTRON MICROSCOPY (2.89 Å)
主引用文献Assembly-mediated activation of the SIR2-HerA supramolecular complex for anti-phage defense.
Mol.Cell, 83, 2023
8UAE
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BU of 8uae by Molmil
E. coli Sir2_HerA complex (12:6) with ATPgamaS
分子名称: MAGNESIUM ION, Nucleoside triphosphate hydrolase, PHOSPHOTHIOPHOSPHORIC ACID-ADENYLATE ESTER, ...
著者Shen, Z.F, Lin, Q.P, Fu, T.M.
登録日2023-09-20
公開日2023-12-27
最終更新日2024-03-27
実験手法ELECTRON MICROSCOPY (3.25 Å)
主引用文献Assembly-mediated activation of the SIR2-HerA supramolecular complex for anti-phage defense.
Mol.Cell, 83, 2023
8UAF
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BU of 8uaf by Molmil
E. coli Sir2_HerA complex (12:6) bound with NAD+
分子名称: ADENOSINE-5'-DIPHOSPHATE, MAGNESIUM ION, NICOTINAMIDE-ADENINE-DINUCLEOTIDE, ...
著者Shen, Z.F, Lin, Q.P, Fu, T.M.
登録日2023-09-20
公開日2023-12-27
最終更新日2024-03-27
実験手法ELECTRON MICROSCOPY (3.18 Å)
主引用文献Assembly-mediated activation of the SIR2-HerA supramolecular complex for anti-phage defense.
Mol.Cell, 83, 2023
2H6V
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BU of 2h6v by Molmil
Spectroscopic and structural study of the heterotropic linkage between halide and proton ion binding to GFP proteins- E2(GFP) APO FORM
分子名称: Green fluorescent protein, SODIUM ION
著者Garau, G.
登録日2006-06-01
公開日2007-05-15
最終更新日2024-10-30
実験手法X-RAY DIFFRACTION (1.47 Å)
主引用文献Spectroscopic and Structural Study of Proton and Halide Ion Cooperative Binding to GFP
Biophys.J., 93, 2007
1THY
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BU of 1thy by Molmil
REFINED STRUCTURES OF SUBSTRATE-BOUND AND PHOSPHATE-BOUND THYMIDYLATE SYNTHASE FROM LACTOBACILLUS CASEI
分子名称: 2'-DEOXYURIDINE 5'-MONOPHOSPHATE, THYMIDYLATE SYNTHASE
著者Finer-Moore, J, Stroud, R.
登録日1993-04-02
公開日1993-10-31
最終更新日2024-02-14
実験手法X-RAY DIFFRACTION (2.9 Å)
主引用文献Refined structures of substrate-bound and phosphate-bound thymidylate synthase from Lactobacillus casei.
J.Mol.Biol., 232, 1993
2I7Z
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BU of 2i7z by Molmil
GAAA tetraloop receptor complex with associated manganese ions.
分子名称: 43-MER, MANGANESE (II) ION
著者Davis, J.H, Butcher, S.E.
登録日2006-08-31
公開日2007-04-03
最終更新日2024-05-01
実験手法SOLUTION NMR
主引用文献Role of metal ions in the tetraloop-receptor complex as analyzed by NMR.
Rna, 13, 2007
6RVO
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BU of 6rvo by Molmil
Multicrystal dataset of thaumatin collected using a multilayer monochromator.
分子名称: L(+)-TARTARIC ACID, Thaumatin I
著者Sandy, J, Sanchez-Weatherby, J, Mikolajek, H, Winter, G.
登録日2019-05-31
公開日2019-06-19
最終更新日2024-10-23
実験手法X-RAY DIFFRACTION (1.97 Å)
主引用文献Protein-to-structure pipeline for ambient-temperature crystallography at VMXi
Iucrj, 2023

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件を2025-07-09に公開中

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