1FSD
 
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6WK8
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1G2X
 | | Sequence induced trimerization of krait PLA2: crystal structure of the trimeric form of krait PLA2 | | Descriptor: | PHOSPHOLIPASE A2 | | Authors: | Singh, G, Gourinath, S, Sharma, S, Bhanumathi, S, Paramsivam, M, Singh, T.P. | | Deposit date: | 2000-10-22 | | Release date: | 2003-06-17 | | Last modified: | 2024-10-30 | | Method: | X-RAY DIFFRACTION (2.5 Å) | | Cite: | Sequence-induced trimerization of phospholipase A2: structure of a trimeric isoform of PLA2 from common krait (Bungarus caeruleus) at 2.5 A resolution.
Acta Crystallogr.,Sect.F, 61, 2005
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6N36
 | | Beta-lactamase from Chitinophaga pinensis | | Descriptor: | 1,2-ETHANEDIOL, Beta-lactamase, ZINC ION | | Authors: | Osipiuk, J, Tesar, C, Endres, M, Joachimiak, A, Center for Structural Genomics of Infectious Diseases (CSGID) | | Deposit date: | 2018-11-14 | | Release date: | 2018-11-28 | | Last modified: | 2023-10-11 | | Method: | X-RAY DIFFRACTION (1.45 Å) | | Cite: | Beta-lactamase from Chitinophaga pinensis
to be published
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6WGM
 | | Crystal structure of a marine metagenome TRAP solute binding protein specific for pyroglutamate (Sorcerer II Global Ocean Sampling Expedition, unidentified microbe, scf7180008839099) in complex with co-purified pyroglutamate | | Descriptor: | 1,2-ETHANEDIOL, CHLORIDE ION, FORMIC ACID, ... | | Authors: | Fedorov, E, Vetting, M.W, Hogle, S.L, Dupont, C.L, Almo, S.C, Ghosh, A. | | Deposit date: | 2020-04-05 | | Release date: | 2020-04-29 | | Last modified: | 2023-10-18 | | Method: | X-RAY DIFFRACTION (1.4 Å) | | Cite: | Crystal structure of a marine metagenome TRAP solute binding protein specific for aromatic acid ligands (Sorcerer II Global Ocean Sampling Expedition, unidentified microbe, GOS_140), in complex with co-purified pyroglutamate
To Be Published
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7PNG
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6XJ9
 | | Structure of PfGH50B | | Descriptor: | 1,2-ETHANEDIOL, Agarase | | Authors: | Pluvinage, B, Boraston, A.B. | | Deposit date: | 2020-06-23 | | Release date: | 2020-09-16 | | Last modified: | 2023-10-18 | | Method: | X-RAY DIFFRACTION (2 Å) | | Cite: | The structure of PfGH50B, an agarase from the marine bacterium Pseudoalteromonas fuliginea PS47
Acta Crystallogr.,Sect.F, 76, 2020
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6XNR
 | | Crystal structure of Rhagium Mordax antifreeze protein | | Descriptor: | 1,2-ETHANEDIOL, Antifreeze protein | | Authors: | Ye, Q, Eves, R, Campbell, R.L, Davies, P.L. | | Deposit date: | 2020-07-04 | | Release date: | 2020-08-26 | | Last modified: | 2024-10-30 | | Method: | X-RAY DIFFRACTION (2.05 Å) | | Cite: | Crystal structure of an insect antifreeze protein reveals ordered waters on the ice-binding surface.
Biochem.J., 477, 2020
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9VS1
 | | Crystal structure of SARS-CoV-2 3CL protease in complex with compound 15 | | Descriptor: | 1,2-ETHANEDIOL, 3C-like proteinase, 4-chloranyl-3-[6-methyl-3-[(1-methyl-1,2,4-triazol-3-yl)methyl]-2,4,5-tris(oxidanylidene)-1-[[3,4,5-tris(fluoranyl)phenyl]methyl]pyrido[4,3-d]pyrimidin-7-yl]benzenecarbonitrile | | Authors: | Yamamoto, S, Taoda, Y. | | Deposit date: | 2025-07-08 | | Release date: | 2025-09-24 | | Method: | X-RAY DIFFRACTION (1.7 Å) | | Cite: | Design, synthesis and biological evaluation of novel quinazolinedione derivatives as non-covalent SARS-CoV-2 3CL protease inhibitors.
Bioorg.Med.Chem.Lett., 129, 2025
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9O7S
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9OLN
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9R0X
 | | Crystal structure of NDM-1 with thiol compound 14a | | Descriptor: | CHLORIDE ION, Metallo-beta-lactamase type 2, SULFATE ION, ... | | Authors: | Hinchliffe, P, Spencer, J. | | Deposit date: | 2025-04-24 | | Release date: | 2025-07-09 | | Method: | X-RAY DIFFRACTION (1.13 Å) | | Cite: | Repurposing of compound libraries yields new inhibitors of NDM-1 metallo-beta-lactamase with diverse zinc-binding moieties
Eur J Med Chem Rep, 15, 2025
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9RI0
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9OP3
 | | Structure of Human ADAR2-R2D complexed with dsRNA containing 8-azaN and 2'-Deoxy-2'-fluorouridine | | Descriptor: | 1,2-ETHANEDIOL, Double-stranded RNA-specific editase 1, INOSITOL HEXAKISPHOSPHATE, ... | | Authors: | Campbell, K.B, Ouye, R.B, Wong, B.L, Jiang, A, Okada, K, McKenney, R.J, Fisher, A.J, Beal, P.A. | | Deposit date: | 2025-05-16 | | Release date: | 2025-10-08 | | Method: | X-RAY DIFFRACTION (2.59 Å) | | Cite: | Control of ADAR2 Dimerization and RNA Editing Efficiency by Site-specific 2'-Fluoro Modification of Guide RNAs
To Be Published
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9P0W
 | | Human carbonic anhydrase II in complex with TDP4 | | Descriptor: | 3,3,3-trifluoro-2,2-dihydroxy-1-(4-methoxyphenyl)propan-1-one, Carbonic anhydrase 2, DIMETHYL SULFOXIDE, ... | | Authors: | Gulkis, M.C, McKenna, R, Lomelino, C, Mahon, B.P, Sechi, M. | | Deposit date: | 2025-06-07 | | Release date: | 2025-10-08 | | Method: | X-RAY DIFFRACTION (1.88 Å) | | Cite: | Design, anticancer activity, and mechanistic evaluation of a novel class of selective human carbonic anhydrase IX inhibitors featuring a trifluorodihydroxypropanone pharmacophore.
Eur.J.Med.Chem., 298, 2025
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9O85
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9PBB
 | | 293K human S-adenosylmethionine decarboxylase | | Descriptor: | 1,4-DIAMINOBUTANE, 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, S-adenosylmethionine decarboxylase alpha chain, ... | | Authors: | Patel, J.R, Bonzon, T.J, Bahkt, T, Fagbohun, O.O, Clinger, J.A. | | Deposit date: | 2025-06-26 | | Release date: | 2025-09-17 | | Last modified: | 2025-10-08 | | Method: | X-RAY DIFFRACTION (2.17 Å) | | Cite: | Multi-Temperature Crystallography of S-Adenosylmethionine Decarboxylase Observes Dynamic Loop Motions.
Biomolecules, 15, 2025
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9R0Y
 | | Crystal structure of NDM-1 with thiol compound 22b | | Descriptor: | Metallo-beta-lactamase type 2, SULFATE ION, ZINC ION, ... | | Authors: | Hinchliffe, P, Spencer, J. | | Deposit date: | 2025-04-24 | | Release date: | 2025-07-09 | | Method: | X-RAY DIFFRACTION (1.27 Å) | | Cite: | Repurposing of compound libraries yields new inhibitors of NDM-1 metallo-beta-lactamase with diverse zinc-binding moieties
Eur J Med Chem Rep, 15, 2025
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9ON0
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9O93
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9Y5Q
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9OQB
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9RBT
 | | X-ray structure of decavanadate/lysozyme adduct obtained when the protein is treated with Cs2[V(V)2O4(mal)2]2H2O (structure B) | | Descriptor: | 2-[(4~{S})-1,1,6,6-tetrakis(oxidanyl)-3-oxidanylidene-2,5$l^{3},7-trioxa-1$l^{5},6$l^{4}-divanadabicyclo[3.2.0]heptan-4-yl]ethanoic acid, ACETATE ION, CHLORIDE ION, ... | | Authors: | Paolillo, M, Ferraro, G, Merlino, A. | | Deposit date: | 2025-05-27 | | Release date: | 2025-08-13 | | Last modified: | 2025-10-29 | | Method: | X-RAY DIFFRACTION (1.18 Å) | | Cite: | Speciation and structural transformation of a V V -malate complex in the absence and in the presence of a protein: from a dinuclear species to decavanadate.
Inorg Chem Front, 12, 2025
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9QF2
 | | Cryo-EM structure of the fully Coronin-1B-decorated actin filament in the ADP state. | | Descriptor: | ADENOSINE-5'-DIPHOSPHATE, Actin, cytoplasmic 1, ... | | Authors: | Oosterheert, W, Boiero Sanders, M, Hofnagel, O, Bieling, P, Raunser, S. | | Deposit date: | 2025-03-11 | | Release date: | 2025-10-08 | | Last modified: | 2025-10-22 | | Method: | ELECTRON MICROSCOPY (2.42 Å) | | Cite: | Choreography of rapid actin filament disassembly by coronin, cofilin, and AIP1.
Cell, 2025
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9RQ1
 | | Fragment screening of FosAKP, cryo structure in complex with fragment F2X-entry C08 | | Descriptor: | (3S)-3-hydroxy-2-methyl-2,3-dihydro-1H-isoindol-1-one, 1,2-ETHANEDIOL, DIMETHYL SULFOXIDE, ... | | Authors: | Guenther, S, Galchenkova, M, Fischer, P, Reinke, P.Y.A, Falke, S, Thekku Veedu, S, Rodrigues, A.C, Senst, J, Meents, A. | | Deposit date: | 2025-06-25 | | Release date: | 2025-10-15 | | Last modified: | 2025-10-22 | | Method: | X-RAY DIFFRACTION (1.13 Å) | | Cite: | Room-temperature X-ray fragment screening with serial crystallography.
Nat Commun, 16, 2025
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