PDB: 244693 resultsInfo pagesStatus searchChemie searchBIRD

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8VDA	Crystal structure of Bacillus subtilis FabHA-coenzyme A complex Descriptor: Beta-ketoacyl-[acyl-carrier-protein] synthase III 1, COENZYME A Authors: Radka, C.D, Rock, C.O. Deposit date: 2023-12-14 Release date: 2024-02-14 Method: X-RAY DIFFRACTION (2.02 Å) Cite: Crystal structures of the fatty acid biosynthesis initiation enzymes in Bacillus subtilis. J.Struct.Biol., 216, 2024
8BZ5	Crystal structure of the L. monocytogenes RmlT in complex with HEPES Descriptor: 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, Glycosyltransferase Authors: Cereija, T.B, Morais-Cabral, J.H. Deposit date: 2022-12-14 Release date: 2023-12-27 Last modified: 2025-02-05 Method: X-RAY DIFFRACTION (2.3 Å) Cite: Molecular properties of the RmlT wall teichoic acid rhamnosyltransferase that modulates virulence in Listeria monocytogenes. Nat Commun, 16, 2025
7BQ2	X-ray structure of human PPARalpha ligand binding domain-pemafibrate-SRC1 coactivator peptide co-crystals obtained by soaking Descriptor: (2~{R})-2-[3-[[1,3-benzoxazol-2-yl-[3-(4-methoxyphenoxy)propyl]amino]methyl]phenoxy]butanoic acid, 15-meric peptide from Nuclear receptor coactivator 1, GLYCEROL, ... Authors: Kamata, S, Ishikawa, R, Akahane, M, Oyama, T, Ishii, I. Deposit date: 2020-03-23 Release date: 2020-11-11 Last modified: 2023-11-29 Method: X-RAY DIFFRACTION (1.52 Å) Cite: PPAR alpha Ligand-Binding Domain Structures with Endogenous Fatty Acids and Fibrates. Iscience, 23, 2020
8VD9	Crystal structure of Bacillus subtilis FabHA, beta-ketoacyl carrier protein synthase III Descriptor: 2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACID, Beta-ketoacyl-[acyl-carrier-protein] synthase III 1 Authors: Radka, C.D, Rock, C.O. Deposit date: 2023-12-14 Release date: 2024-02-14 Method: X-RAY DIFFRACTION (1.85 Å) Cite: Crystal structures of the fatty acid biosynthesis initiation enzymes in Bacillus subtilis. J.Struct.Biol., 216, 2024
8V8C	Alpha7-nicotinic acetylcholine receptor time resolved bound to epibatidine and PNU-120596 asymmetric state 1 Descriptor: 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, ... Authors: Burke, S.M, Noviello, C.M, Hibbs, R.E. Deposit date: 2023-12-05 Release date: 2024-02-21 Last modified: 2025-05-28 Method: ELECTRON MICROSCOPY (3.29 Å) Cite: Structural mechanisms of alpha 7 nicotinic receptor allosteric modulation and activation. Cell, 187, 2024
6X3C	Crystal structure of streptogramin A acetyltransferase VatA from Staphylococcus aureus in complex with streptogramin analog F1037 (47) Descriptor: (3R,4R,5E,10E,12E,14S,16R,26aR)-16-fluoro-14-hydroxy-12-methyl-3-(propan-2-yl)-4-(prop-2-en-1-yl)-3,4,8,9,14,15,16,17,24,25,26,26a-dodecahydro-1H,7H,22H-21,18-(azeno)pyrrolo[2,1-c][1,8,4,19]dioxadiazacyclotetracosine-1,7,22-trione, CHLORIDE ION, MAGNESIUM ION, ... Authors: Chaires, H.A, Fraser, J.S. Deposit date: 2020-05-21 Release date: 2020-11-18 Last modified: 2023-10-18 Method: X-RAY DIFFRACTION (3.05 Å) Cite: Synthetic group A streptogramin antibiotics that overcome Vat resistance. Nature, 586, 2020
1A54	PHOSPHATE-BINDING PROTEIN MUTANT A197C LABELLED WITH A COUMARIN FLUOROPHORE AND BOUND TO DIHYDROGENPHOSPHATE ION Descriptor: DIHYDROGENPHOSPHATE ION, N-[2-(1-MALEIMIDYL)ETHYL]-7-DIETHYLAMINOCOUMARIN-3-CARBOXAMIDE, Phosphate-binding protein PstS Authors: Hirshberg, M, Henrick, K, Lloyd-Haire, L, Vasisht, N, Brune, M, Corrie, J.E.T, Webb, M.R. Deposit date: 1998-02-19 Release date: 1998-10-14 Last modified: 2024-12-25 Method: X-RAY DIFFRACTION (1.6 Å) Cite: Crystal structure of phosphate binding protein labeled with a coumarin fluorophore, a probe for inorganic phosphate. Biochemistry, 37, 1998
7RFR	Structure of SARS-CoV-2 main protease in complex with a covalent inhibitor Descriptor: (1R,2S,5S)-N-{(1S,2S)-1-(1,3-benzothiazol-2-yl)-1-hydroxy-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl}-3-(4-methoxy-1H-indole-2-carbonyl)-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-2-carboxamide, 3C-like proteinase Authors: Gajiwala, K.S, Ferre, R.A, Liu, W, Stewart, A.E. Deposit date: 2021-07-14 Release date: 2021-11-10 Last modified: 2024-11-06 Method: X-RAY DIFFRACTION (1.626 Å) Cite: An oral SARS-CoV-2 M pro inhibitor clinical candidate for the treatment of COVID-19. Science, 374, 2021
8H2X	Structure of Acb2 Descriptor: 1,2-ETHANEDIOL, GLYCEROL, p26 Authors: Feng, Y, Cao, X.L. Deposit date: 2022-10-07 Release date: 2023-02-22 Last modified: 2024-05-29 Method: X-RAY DIFFRACTION (2.69 Å) Cite: Bacteriophages inhibit and evade cGAS-like immune function in bacteria. Cell, 186, 2023
7BU0	Crystal structure of a OTU deubiquitinase in complex with Ub-PA Descriptor: Polyubiquitin-B, Uncharacterized protein, prop-2-en-1-amine Authors: Ouyang, S.Y, Zhen, X.K. Deposit date: 2020-04-03 Release date: 2020-11-18 Last modified: 2023-04-05 Method: X-RAY DIFFRACTION (2.43 Å) Cite: Interplay between bacterial deubiquitinase and ubiquitin E3 ligase regulates ubiquitin dynamics on Legionella phagosomes. Elife, 9, 2020
7RQ8	Crystal structure of the wild-type Thermus thermophilus 70S ribosome in complex with iboxamycin, mRNA, deacylated A- and E-site tRNAs, and aminoacylated P-site tRNA at 2.50A resolution Descriptor: 16S Ribosomal RNA, 23S Ribosomal RNA, 30S ribosomal protein S10, ... Authors: Mitcheltree, M.J, Pisipati, A, Syroegin, E.A, Silvestre, K.J, Klepacki, D, Mason, J.D, Terwilliger, D.W, Testolin, G, Pote, A.R, Wu, K.J.Y, Ladley, R.P, Chatman, K, Mankin, A.S, Polikanov, Y.S, Myers, A.G. Deposit date: 2021-08-06 Release date: 2021-10-13 Last modified: 2025-03-19 Method: X-RAY DIFFRACTION (2.5 Å) Cite: A synthetic antibiotic class overcoming bacterial multidrug resistance. Nature, 599, 2021
8X4A	Cryo-EM structure of Ryanodine receptor 1 (TM helix S0,100 nM Ca2+, closed state) Descriptor: CALCIUM ION, Ryanodine receptor 1 Authors: Chen, Q, Hu, H. Deposit date: 2023-11-15 Release date: 2025-03-05 Last modified: 2025-03-12 Method: ELECTRON MICROSCOPY (3.8 Å) Cite: Structural insights into transmembrane helix S0 facilitated RyR1 channel gating by Ca 2+ /ATP. Nat Commun, 16, 2025
8BVX	Structure of the mouse 8-oxoguanine DNA Glycosylase mOGG1 in complex with ligand TH13264 Descriptor: 1,2-ETHANEDIOL, N-glycosylase/DNA lyase, NICKEL (II) ION, ... Authors: Scaletti, E, Stenmark, P. Deposit date: 2022-12-05 Release date: 2024-05-15 Method: X-RAY DIFFRACTION (2.35 Å) Cite: Structure of the mouse 8-oxoguanine DNA Glycosylase mOGG1 in complex with ligand TH13264 To Be Published
6QP5	Apo Human Calcium/Calmodulin-dependent kinase type 1D Descriptor: 1,2-ETHANEDIOL, Calcium/calmodulin-dependent protein kinase type 1D, SULFATE ION Authors: Sorrell, F.J, Knapp, S. Deposit date: 2019-02-13 Release date: 2020-03-04 Last modified: 2024-01-24 Method: X-RAY DIFFRACTION (1.9 Å) Cite: Apo Human Calcium/Calmodulin-dependent kinase type 1D To Be Published
7BYL	Cryo-EM structure of human KCNQ4 Descriptor: Calmodulin-3, Green fluorescent protein,Potassium voltage-gated channel subfamily KQT member 4, POTASSIUM ION, ... Authors: Shen, H, Li, T, Yue, Z. Deposit date: 2020-04-23 Release date: 2020-12-02 Last modified: 2025-07-02 Method: ELECTRON MICROSCOPY (2.5 Å) Cite: Structural Basis for the Modulation of Human KCNQ4 by Small-Molecule Drugs. Mol.Cell, 81, 2021
6OAH	Crystal structure of human FPPS in complex with an allosteric inhibitor YF-02-78 Descriptor: Farnesyl pyrophosphate synthase, GLYCEROL, PHOSPHATE ION, ... Authors: Park, J, Berghuis, A.M. Deposit date: 2019-03-16 Release date: 2019-11-06 Last modified: 2023-10-11 Method: X-RAY DIFFRACTION (2.2 Å) Cite: Chirality-Driven Mode of Binding of alpha-Aminophosphonic Acid-Based Allosteric Inhibitors of the Human Farnesyl Pyrophosphate Synthase (hFPPS). J.Med.Chem., 62, 2019
4RVO	Crystal structure of a Putative Acyl-CoA ligase (BT_0428) from Bacteroides thetaiotaomicron VPI-5482 at 2.41 A resolution Descriptor: 1,2-ETHANEDIOL, ADENOSINE-5'-DIPHOSPHATE, DI(HYDROXYETHYL)ETHER, ... Authors: Joint Center for Structural Genomics (JCSG) Deposit date: 2014-11-26 Release date: 2014-12-31 Last modified: 2024-11-20 Method: X-RAY DIFFRACTION (2.41 Å) Cite: Crystal structure of a Putative Acyl-CoA ligase (BT_0428) from Bacteroides thetaiotaomicron VPI-5482 at 2.41 A resolution To be published
8X4C	Cryo-EM structure of Ryanodine receptor 1 (20 uM Ca2+, 2 mM ATP) Descriptor: ADENOSINE-5'-TRIPHOSPHATE, CALCIUM ION, Ryanodine receptor 1 Authors: Chen, Q, Hu, H. Deposit date: 2023-11-15 Release date: 2025-03-05 Last modified: 2025-03-12 Method: ELECTRON MICROSCOPY (3.8 Å) Cite: Structural insights into transmembrane helix S0 facilitated RyR1 channel gating by Ca 2+ /ATP. Nat Commun, 16, 2025
8X4B	Cryo-EM structure of Ryanodine receptor 1 (TM helix S0,100 nM Ca2+, open state) Descriptor: CALCIUM ION, Ryanodine receptor 1 Authors: Chen, Q, Hu, H. Deposit date: 2023-11-15 Release date: 2025-03-05 Last modified: 2025-03-12 Method: ELECTRON MICROSCOPY (4.2 Å) Cite: Structural insights into transmembrane helix S0 facilitated RyR1 channel gating by Ca 2+ /ATP. Nat Commun, 16, 2025
8BM8	Crystal Structure of Ephrin A2 (EphA2) Receptor Protein Kinase with Compound 11 Descriptor: Ephrin type-A receptor 2, ~{N}-(3-cyanophenyl)-4-methyl-3-[(1-methyl-6-pyridin-3-yl-pyrazolo[3,4-d]pyrimidin-4-yl)amino]benzamide Authors: Linhard, V, Witt, K, Gande, S, Wollenhaupt, J, Lennartz, F, Weiss, M.S, Schwalbe, H. Deposit date: 2022-11-10 Release date: 2024-06-05 Method: X-RAY DIFFRACTION (1.68 Å) Cite: (placeholder, will be filled after publication) To Be Published
8HUA	Serial synchrotron crystallography structure of ba3-type cytochrome c oxidase from Thermus thermophilus using a goniometer compatible flow-cell Descriptor: (2R)-2,3-dihydroxypropyl (9Z)-octadec-9-enoate, COPPER (II) ION, Cytochrome c oxidase polypeptide 2A, ... Authors: Ghosh, S, Zoric, D, Bjelcic, M, Johannesson, J, Sandelin, E, Branden, G, Neutze, R. Deposit date: 2022-12-22 Release date: 2023-03-01 Last modified: 2024-05-29 Method: X-RAY DIFFRACTION (2.12 Å) Cite: A simple goniometer-compatible flow cell for serial synchrotron X-ray crystallography. J.Appl.Crystallogr., 56, 2023
6O7L	Nitrogenase MoFeP mutant S188A from Azotobacter vinelandii in the dithionite reduced state after redox cycling Descriptor: 3-HYDROXY-3-CARBOXY-ADIPIC ACID, FE (III) ION, FE(8)-S(7) CLUSTER, ... Authors: Rutledge, H.L, Tezcan, F.A. Deposit date: 2019-03-08 Release date: 2019-06-19 Last modified: 2023-10-11 Method: X-RAY DIFFRACTION (2.26 Å) Cite: Redox-Dependent Metastability of the Nitrogenase P-Cluster. J.Am.Chem.Soc., 141, 2019
6Z8C	Crystal Structure of the Voltage-Gated Sodium Channel NavMs (F208L) in complex with N-desmethyltamoxifen (3.2 A resolution) Descriptor: 2-[4-[(~{Z})-1,2-diphenylbut-1-enyl]phenoxy]-~{N}-methyl-ethanamine, DODECAETHYLENE GLYCOL, HEGA-10, ... Authors: Sula, A, Hollingworth, D, Wallace, B.A. Deposit date: 2020-06-02 Release date: 2021-02-03 Last modified: 2024-01-24 Method: X-RAY DIFFRACTION (3.2 Å) Cite: A tamoxifen receptor within a voltage-gated sodium channel. Mol.Cell, 81, 2021
8X4E	Cryo-EM structure of Ryanodine receptor 1 (TM helix S0, 5 mM Ca2+) Descriptor: CALCIUM ION, Ryanodine receptor 1, ZINC ION Authors: Chen, Q, Hu, H. Deposit date: 2023-11-15 Release date: 2025-03-05 Last modified: 2025-03-12 Method: ELECTRON MICROSCOPY (3.3 Å) Cite: Structural insights into transmembrane helix S0 facilitated RyR1 channel gating by Ca 2+ /ATP. Nat Commun, 16, 2025
8X4D	Cryo-EM structure of Ryanodine receptor 1 (TM helix S0,20 uM Ca2+, 2 mM ATP) Descriptor: ADENOSINE-5'-TRIPHOSPHATE, CALCIUM ION, Ryanodine receptor 1 Authors: Chen, Q, Hu, H. Deposit date: 2023-11-15 Release date: 2025-03-05 Last modified: 2025-03-12 Method: ELECTRON MICROSCOPY (3.9 Å) Cite: Structural insights into transmembrane helix S0 facilitated RyR1 channel gating by Ca 2+ /ATP. Nat Commun, 16, 2025

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