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6C7P
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Crystal structure of D477G ACO/RPE65 chimera, monoclinic crystal form
分子名称: Apocarotenoid-15,15'-oxygenase, FE (II) ION
著者Kiser, P.D, Shi, W.
登録日2018-01-23
公開日2018-04-25
最終更新日2023-10-04
実験手法X-RAY DIFFRACTION (2.6 Å)
主引用文献Insights into the pathogenesis of dominant retinitis pigmentosa associated with a D477G mutation in RPE65.
Hum.Mol.Genet., 27, 2018
3P9T
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BU of 3p9t by Molmil
SmeT-Triclosan complex
分子名称: Repressor, SULFATE ION, TRICLOSAN
著者Hernandez, A, Ruiz, F.M, Romero, A, Martinez, J.L.
登録日2010-10-18
公開日2011-08-10
最終更新日2023-09-06
実験手法X-RAY DIFFRACTION (2.02 Å)
主引用文献The Binding of Triclosan to SmeT, the Repressor of the Multidrug Efflux Pump SmeDEF, Induces Antibiotic Resistance in Stenotrophomonas maltophilia.
Plos Pathog., 7, 2011
6H0U
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BU of 6h0u by Molmil
Glycogen synthase kinase-3 beta (GSK3) complex with a covalent [1,2,4]triazolo[1,5-a][1,3,5]triazine inhibitor
分子名称: (2~{R})-3-[7-azanyl-5-(cyclohexylamino)-[1,2,4]triazolo[1,5-a][1,3,5]triazin-2-yl]-2-cyano-propanamide, CHLORIDE ION, GLYCEROL, ...
著者Marcovich, I, Demitri, N, De Zorzi, R, Storici, P.
登録日2018-07-10
公開日2019-05-15
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献A Triazolotriazine-Based Dual GSK-3 beta /CK-1 delta Ligand as a Potential Neuroprotective Agent Presenting Two Different Mechanisms of Enzymatic Inhibition.
Chemmedchem, 14, 2019
5LZX
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BU of 5lzx by Molmil
Structure of the mammalian rescue complex with Pelota and Hbs1l assembled on a UGA stop codon.
分子名称: 18S ribosomal RNA, 28S ribosomal RNA, 40S ribosomal protein S12, ...
著者Shao, S, Murray, J, Brown, A, Taunton, J, Ramakrishnan, V, Hegde, R.S.
登録日2016-10-02
公開日2016-11-30
最終更新日2024-05-15
実験手法ELECTRON MICROSCOPY (3.67 Å)
主引用文献Decoding Mammalian Ribosome-mRNA States by Translational GTPase Complexes.
Cell, 167, 2016
8BGN
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N,N-diacetylchitobiose deacetylase from Pyrococcus chitonophagus
分子名称: 1,2-ETHANEDIOL, CHLORIDE ION, Diacetylchitobiose deacetylase, ...
著者Rypniewski, W, Bejger, M, Biniek-Antosiak, K.
登録日2022-10-28
公開日2023-01-11
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (2.76 Å)
主引用文献Structural, Thermodynamic and Enzymatic Characterization of N , N -Diacetylchitobiose Deacetylase from Pyrococcus chitonophagus.
Int J Mol Sci, 23, 2022
5LVG
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Hen Egg White Lysozyme co-crystallized with cis-Ru(DMSO)4Cl2
分子名称: ACETATE ION, CHLORIDE ION, Lysozyme C, ...
著者Kurpiewska, K, Halajko, P, Lewinski, K.
登録日2016-09-14
公開日2016-09-21
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Ligand-dependent interaction of anticancer ruthenium complexes with hen egg white lysozyme and human lysozyme
To Be Published
6M5N
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BU of 6m5n by Molmil
Apo-Form Structure of Borneol Dehydrogenase
分子名称: ACETATE ION, Borneol dehydrogenase, SULFATE ION
著者Khine, A.A, Huang, K.F, Ko, T.P, Chen, H.P.
登録日2020-03-11
公開日2020-07-15
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (1.84 Å)
主引用文献Structural characterization of borneol dehydrogenase from Pseudomonas sp. TCU-HL1
Acta Crystallogr.,Sect.F, 76, 2020
8EBU
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BU of 8ebu by Molmil
XPC release from Core7-XPA-DNA (Cy5)
分子名称: DNA repair protein complementing XP-A cells, DNA repair protein complementing XP-C cells, DNA1, ...
著者Kim, J, Yang, W.
登録日2022-08-31
公開日2023-04-19
最終更新日2024-06-19
実験手法ELECTRON MICROSCOPY (3.3 Å)
主引用文献Lesion recognition by XPC, TFIIH and XPA in DNA excision repair.
Nature, 617, 2023
5LVK
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Human Lysozyme co-crystallized with [H2Ind][trans-RuCl4(DMSO)(HInd)]
分子名称: CHLORIDE ION, Lysozyme C, NITRATE ION, ...
著者Kurpiewska, K, Szura, A, Lewinski, K.
登録日2016-09-14
公開日2016-09-28
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (2.491 Å)
主引用文献Ligand-dependent interaction of anticancer ruthenium complexes with hen egg white lysozyme and human lysozyme
To Be Published
8BEF
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BU of 8bef by Molmil
Cryo-EM structure of the Arabidopsis thaliana I+III2 supercomplex (CI membrane core)
分子名称: (1S)-2-{[{[(2R)-2,3-DIHYDROXYPROPYL]OXY}(HYDROXY)PHOSPHORYL]OXY}-1-[(PALMITOYLOXY)METHYL]ETHYL STEARATE, (7S)-4-HYDROXY-N,N,N-TRIMETHYL-9-OXO-7-[(PALMITOYLOXY)METHYL]-3,5,8-TRIOXA-4-PHOSPHAHEXACOSAN-1-AMINIUM 4-OXIDE, 1,2-DIACYL-GLYCEROL-3-SN-PHOSPHATE, ...
著者Klusch, N, Kuehlbrandt, W.
登録日2022-10-21
公開日2023-01-11
最終更新日2023-02-01
実験手法ELECTRON MICROSCOPY (2.13 Å)
主引用文献Cryo-EM structure of the respiratory I + III 2 supercomplex from Arabidopsis thaliana at 2 angstrom resolution.
Nat.Plants, 9, 2023
6MG9
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BU of 6mg9 by Molmil
Human Obscurin Ig57 Domain
分子名称: Obscurin
著者Wright, N.T, Whitley, J.A.
登録日2018-09-13
公開日2019-02-06
最終更新日2024-05-01
実験手法SOLUTION NMR
主引用文献Obscurin is a semi-flexible molecule in solution.
Protein Sci., 28, 2019
8BGO
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BU of 8bgo by Molmil
N,N-diacetylchitobiose deacetylase from Pyrococcus chitonophagus with substrate N,N-diacetylchitobiose
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, Diacetylchitobiose deacetylase, ZINC ION
著者Rypniewski, W, Bejger, M, Biniek-Antosiak, K.
登録日2022-10-28
公開日2023-01-11
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (3.08 Å)
主引用文献Structural, Thermodynamic and Enzymatic Characterization of N , N -Diacetylchitobiose Deacetylase from Pyrococcus chitonophagus.
Int J Mol Sci, 23, 2022
8B3L
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BU of 8b3l by Molmil
Hen Egg White Lysozyme 2s in situ crystallization
分子名称: 1,2-ETHANEDIOL, ACETATE ION, CHLORIDE ION, ...
著者Henkel, A, Galchenkova, M, Yefanov, O, Hakanpaeae, J, Chapman, H.N, Oberthuer, D.
登録日2022-09-16
公開日2022-12-21
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (1.71 Å)
主引用文献JINXED: just in time crystallization for easy structure determination of biological macromolecules.
Iucrj, 10, 2023
6H1U
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BU of 6h1u by Molmil
GlnH bound to Asp, Mycobacterium tuberculosis
分子名称: ASPARTIC ACID, Probable glutamine-binding lipoprotein GlnH (GLNBP)
著者O'Hare, H.M, Wallis, R, Lin, L.Y, Newland-Smith, Z.
登録日2018-07-12
公開日2018-08-01
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (1.68 Å)
主引用文献An Aspartate-Specific Solute-Binding Protein Regulates Protein Kinase G Activity To Control Glutamate Metabolism in Mycobacteria.
MBio, 9, 2018
5M3C
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BU of 5m3c by Molmil
Structure of the hybrid domain (GGDEF-EAL) of PA0575 from Pseudomonas aeruginosa PAO1 at 2.8 Ang. with GTP and Ca2+ bound to the active site of the GGDEF domain
分子名称: CALCIUM ION, Diguanylate cyclase, GUANOSINE-5'-TRIPHOSPHATE
著者Giardina, G, Brunotti, P, Cutruzzola, F, Rinaldo, S.
登録日2016-10-14
公開日2017-12-20
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (2.8 Å)
主引用文献Insights into the GTP-dependent allosteric control of c-di-GMP hydrolysis from the crystal structure of PA0575 protein from Pseudomonas aeruginosa.
FEBS J., 285, 2018
5LYE
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BU of 5lye by Molmil
Re-refined structure of the bacteriophage T4 short tail fibre PDB entry 1H6W containing 71 additionally identified residues
分子名称: CHLORIDE ION, Gp12, SULFATE ION
著者van Raaij, M.J, Taylor, N.M.I, Leiman, P.G.
登録日2016-09-27
公開日2018-01-17
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Contractile injection systems of bacteriophages and related systems.
Mol. Microbiol., 108, 2018
8EBY
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BU of 8eby by Molmil
XPC release from Core7-XPA-DNA (AP)
分子名称: DNA, DNA repair protein complementing XP-A cells, DNA repair protein complementing XP-C cells, ...
著者Kim, J, Yang, W.
登録日2022-08-31
公開日2023-04-19
最終更新日2024-06-19
実験手法ELECTRON MICROSCOPY (3.6 Å)
主引用文献Lesion recognition by XPC, TFIIH and XPA in DNA excision repair.
Nature, 617, 2023
8K9R
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BU of 8k9r by Molmil
Cryo EM structure of the products-bound PGAP1(Bst1)-H443N from Chaetomium thermophilum
分子名称: 2-amino-2-deoxy-alpha-D-glucopyranose, 2-azanylethyl [(2R,3S,4S,5S,6S)-3,4,5,6-tetrakis(oxidanyl)oxan-2-yl]methyl hydrogen phosphate, 2-azanylethyl [(2~{S},3~{S},4~{S},5~{S},6~{R})-6-(hydroxymethyl)-2,4,5-tris(oxidanyl)oxan-3-yl] hydrogen phosphate, ...
著者Li, T, Hong, J, Qu, Q, Li, D.
登録日2023-08-01
公開日2023-12-20
最終更新日2024-01-17
実験手法ELECTRON MICROSCOPY (2.68 Å)
主引用文献Molecular basis of the inositol deacylase PGAP1 involved in quality control of GPI-AP biogenesis.
Nat Commun, 15, 2024
6BIG
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BU of 6big by Molmil
Crystal structure of cobalt-substituted Synechocystis ACO
分子名称: Apocarotenoid-15,15'-oxygenase, CHLORIDE ION, COBALT (II) ION
著者Sui, X, Shi, W, Kiser, P.D.
登録日2017-11-02
公開日2018-07-04
最終更新日2023-10-04
実験手法X-RAY DIFFRACTION (2.21 Å)
主引用文献Preparation and characterization of metal-substituted carotenoid cleavage oxygenases.
J. Biol. Inorg. Chem., 23, 2018
8P1G
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BU of 8p1g by Molmil
Crystal structure of inactive TtCE16 in complex with acetate
分子名称: 1,2-ETHANEDIOL, 2-[3-(2-HYDROXY-1,1-DIHYDROXYMETHYL-ETHYLAMINO)-PROPYLAMINO]-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, 2-acetamido-2-deoxy-beta-D-glucopyranose, ...
著者Dimarogona, M, Kosinas, C, Pentari, C, Zerva, A, Topakas, E, Karampa, P.
登録日2023-05-12
公開日2024-03-20
実験手法X-RAY DIFFRACTION (1.42 Å)
主引用文献The role of CE16 exo-deacetylases in hemicellulolytic enzyme mixtures revealed by the biochemical and structural study of the novel TtCE16B esterase.
Carbohydr Polym, 327, 2024
6M9T
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BU of 6m9t by Molmil
Crystal structure of EP3 receptor bound to misoprostol-FA
分子名称: (11alpha,12alpha,13E,16S)-11,16-dihydroxy-16-methyl-9-oxoprost-13-en-1-oic acid, (2R)-2,3-dihydroxypropyl (9Z)-octadec-9-enoate, OLEIC ACID, ...
著者Audet, M, White, K.L, Breton, B, Zarzycka, B, Han, G.W, Lu, Y, Gati, C, Batyuk, A, Popov, P, Velasquez, J, Manahan, D, Hu, H, Weierstall, U, Liu, W, Shui, W, Katrich, V, Cherezov, V, Hanson, M.A, Stevens, R.C.
登録日2018-08-24
公開日2018-12-05
最終更新日2023-10-11
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Crystal structure of misoprostol bound to the labor inducer prostaglandin E2receptor.
Nat. Chem. Biol., 15, 2019
7LOX
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BU of 7lox by Molmil
The structure of Agmatinase from E. Coli at 3.2 A displaying guanidine in the active site
分子名称: Agmatinase, GUANIDINE, MANGANESE (II) ION
著者Maturana, P, Figueroa, M, Gonzalez-Ordenes, F, Villalobos, P, Martinez-Oyanedel, J, Uribe, E.A, Castro-Fernandez, V.
登録日2021-02-11
公開日2021-05-12
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (3.2 Å)
主引用文献Crystal Structure of Escherichia coli Agmatinase: Catalytic Mechanism and Residues Relevant for Substrate Specificity.
Int J Mol Sci, 22, 2021
6LLC
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BU of 6llc by Molmil
Discovery of A Dual Inhibitor of NQO1 and GSTP1 for Treating Malignant Glioblastoma
分子名称: 5-methyl-N-(5-nitro-1,3-thiazol-2-yl)-3-phenyl-1,2-oxazole-4-carboxamide, FLAVIN-ADENINE DINUCLEOTIDE, NAD(P)H dehydrogenase [quinone] 1, ...
著者Ye, K, Li, H.
登録日2019-12-23
公開日2020-11-25
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (2.501 Å)
主引用文献Discovery of a dual inhibitor of NQO1 and GSTP1 for treating glioblastoma.
J Hematol Oncol, 13, 2020
5LZ2
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Fragment-based inhibitors of Lipoprotein associated Phospholipase A2
分子名称: 3-cyano-~{N}-cyclopropyl-benzenesulfonamide, CHLORIDE ION, Platelet-activating factor acetylhydrolase, ...
著者Woolford, A, Day, P.
登録日2016-09-29
公開日2016-12-21
最終更新日2024-06-19
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Fragment-Based Approach to the Development of an Orally Bioavailable Lactam Inhibitor of Lipoprotein-Associated Phospholipase A2 (Lp-PLA2).
J. Med. Chem., 59, 2016
8JPZ
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BU of 8jpz by Molmil
The thermostability mutant Gox_M8 from Aspergillus niger
分子名称: (4S)-2-METHYL-2,4-PENTANEDIOL, 2-acetamido-2-deoxy-beta-D-glucopyranose, 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, ...
著者Tu, T, Yan, Y.R.
登録日2023-06-13
公開日2023-12-20
最終更新日2024-10-16
実験手法X-RAY DIFFRACTION (2.08 Å)
主引用文献Revealing the pH-Dependent Activity Mechanism of a Ferrari Oxidoreductase Enzyme-Glucose Oxidase
To Be Published

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