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8E76
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BU of 8e76 by Molmil
Cryo-EM structure of Apo form ME3
Descriptor: NADP-dependent malic enzyme, mitochondrial
Authors:Yu, X, Grell, T.A.J, Shaffer, P.L, Steele, R, Sharma, S, Thompson, A.A, Tresadern, G, Ortiz-Meoz, R.F, Mason, M, Gomez-Tamayo, J.C, Riley, D, Wagner, M.V, Wadia, J.
Deposit date:2022-08-23
Release date:2023-02-08
Last modified:2024-06-19
Method:ELECTRON MICROSCOPY (2.51 Å)
Cite:Integrative structural and functional analysis of human malic enzyme 3: A potential therapeutic target for pancreatic cancer.
Heliyon, 8, 2022
5V2C
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BU of 5v2c by Molmil
RE-REFINEMENT OF CRYSTAL STRUCTURE OF PHOTOSYSTEM II COMPLEX
Descriptor: 1,2-DI-O-ACYL-3-O-[6-DEOXY-6-SULFO-ALPHA-D-GLUCOPYRANOSYL]-SN-GLYCEROL, 1,2-DIPALMITOYL-PHOSPHATIDYL-GLYCEROLE, 1,2-DISTEAROYL-MONOGALACTOSYL-DIGLYCERIDE, ...
Authors:Wang, J, Wiwczar, J.M, Brudvig, G.W.
Deposit date:2017-03-03
Release date:2017-08-30
Last modified:2023-10-04
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Chlorophyll a with a farnesyl tail in thermophilic cyanobacteria.
Photosyn. Res., 134, 2017
5KHP
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BU of 5khp by Molmil
Tightening the Recognition of Tetravalent Zr and Th Complexes by the Siderophore-Binding Mammalian Protein Siderocalin for Theranostic Applications
Descriptor: GLYCEROL, N,N'-(butane-1,4-diyl)bis(N-{3-[(2,3-dihydroxybenzene-1-carbonyl)amino]propyl}-2,3-dihydroxybenzamide), Neutrophil gelatinase-associated lipocalin, ...
Authors:Rupert, P.B, Strong, R.K.
Deposit date:2016-06-15
Release date:2017-04-26
Last modified:2023-09-27
Method:X-RAY DIFFRACTION (2.65 Å)
Cite:Engineered Recognition of Tetravalent Zirconium and Thorium by Chelator-Protein Systems: Toward Flexible Radiotherapy and Imaging Platforms.
Inorg Chem, 55, 2016
5UVK
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BU of 5uvk by Molmil
Serial Millisecond Crystallography of Membrane and Soluble Protein Micro-crystals using Synchrotron Radiation
Descriptor: C-phycocyanin alpha chain, C-phycocyanin beta chain, PHYCOCYANOBILIN
Authors:Martin-Garcia, J.M, Conrad, C.E, Nelson, G, Stander, N, Zatsepin, N.A, Zook, J, Zhu, L, Geiger, J, Chun, E, Kissick, D, Hilgart, M.C, Ogata, C, Ishchenko, A, Nagaratnam, N, Roy-Chowdhury, S, Coe, J, Subramanian, G, Schaffer, A, James, D, Ketawala, G, Venugopalan, N, Xu, S, Corcoran, S, Ferguson, D, Weierstall, U, Spence, J.C.H, Cherezov, V, Fromme, P, Fischetti, R.F, Liu, W.
Deposit date:2017-02-20
Release date:2017-05-24
Last modified:2023-10-04
Method:X-RAY DIFFRACTION (3.1 Å)
Cite:Serial millisecond crystallography of membrane and soluble protein microcrystals using synchrotron radiation.
Iucrj, 4, 2017
7LVZ
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BU of 7lvz by Molmil
Crystal structure of ADO
Descriptor: 2-aminoethanethiol dioxygenase, CHLORIDE ION, FE (II) ION, ...
Authors:Bingman, C.A, Fernandez, R.L, Smith, R.W, Fox, B.G, Brunold, T.C.
Deposit date:2021-02-26
Release date:2022-01-05
Last modified:2024-04-03
Method:X-RAY DIFFRACTION (1.89 Å)
Cite:The Crystal Structure of Cysteamine Dioxygenase Reveals the Origin of the Large Substrate Scope of This Vital Mammalian Enzyme.
Biochemistry, 60, 2021
5AWO
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BU of 5awo by Molmil
Arthrobacter globiformis T6 isomalto-dextranse
Descriptor: ACETATE ION, Isomaltodextranase, PHOSPHATE ION
Authors:Tonozuka, T.
Deposit date:2015-07-08
Release date:2015-09-09
Last modified:2020-02-26
Method:X-RAY DIFFRACTION (1.44 Å)
Cite:Crystal Structure and Mutational Analysis of Isomalto-dextranase, a Member of Glycoside Hydrolase Family 27
J.Biol.Chem., 290, 2015
6VVA
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BU of 6vva by Molmil
N-Acetylmannosamine-6-phosphate 2-epimerase from Staphylococcus aureus (strain MRSA USA300)
Descriptor: CHLORIDE ION, CITRIC ACID, N-acetylmannosamine-6-phosphate 2-epimerase
Authors:Renwick, R.C.J, Currie, M.J.
Deposit date:2020-02-17
Release date:2021-02-24
Last modified:2023-10-11
Method:X-RAY DIFFRACTION (1.84 Å)
Cite:N-acetylmannosamine-6-phosphate 2-epimerase uses a novel substrate-assisted mechanism to catalyze amino sugar epimerization.
J.Biol.Chem., 297, 2021
8E78
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BU of 8e78 by Molmil
Cryo-EM structure of human ME3 in the presence of citrate
Descriptor: NADP-dependent malic enzyme, mitochondrial
Authors:Yu, X, Grell, T.A.J, Shaffer, P.L, Steele, R, Sharma, S, Thompson, A.A, Tresadern, G, Ortiz-Meoz, R.F, Mason, M, Gomez-Tamayo, J.C, Riley, D, Wagner, M.V, Wadia, J.
Deposit date:2022-08-23
Release date:2023-02-08
Last modified:2024-06-19
Method:ELECTRON MICROSCOPY (2.77 Å)
Cite:Integrative structural and functional analysis of human malic enzyme 3: A potential therapeutic target for pancreatic cancer.
Heliyon, 8, 2022
5V72
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BU of 5v72 by Molmil
Crystal structure of NADPH-dependent glyoxylate/hydroxypyruvate reductase SMc04462 (SmGhrB) from Sinorhizobium meliloti in complex with citrate
Descriptor: CHLORIDE ION, CITRIC ACID, GLYCEROL, ...
Authors:Shabalin, I.G, Handing, K.B, Gasiorowska, O.A, Cooper, D.R, Matelska, D, Bonanno, J, Almo, S.C, Minor, W, New York Structural Genomics Research Consortium (NYSGRC)
Deposit date:2017-03-17
Release date:2017-03-29
Last modified:2023-10-04
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Structural, Biochemical, and Evolutionary Characterizations of Glyoxylate/Hydroxypyruvate Reductases Show Their Division into Two Distinct Subfamilies.
Biochemistry, 57, 2018
8OI7
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BU of 8oi7 by Molmil
Trichomonas vaginalis riboside hydrolase
Descriptor: CALCIUM ION, DI(HYDROXYETHYL)ETHER, Inosine-uridine preferring nucleoside hydrolase family protein, ...
Authors:Patrone, M, Stockman, B.J, Degano, M.
Deposit date:2023-03-22
Release date:2023-08-02
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (1.85 Å)
Cite:A riboside hydrolase that salvages both nucleobases and nicotinamide in the auxotrophic parasite Trichomonas vaginalis.
J.Biol.Chem., 299, 2023
1L4Z
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BU of 1l4z by Molmil
X-RAY CRYSTAL STRUCTURE OF THE COMPLEX OF MICROPLASMINOGEN WITH ALPHA DOMAIN OF STREPTOKINASE IN THE PRESENCE CADMIUM IONS
Descriptor: CADMIUM ION, Plasminogen, Streptokinase
Authors:Wakeham, N, Terzyan, S, Zhai, P, Loy, J.A, Tang, J, Zhang, X.C.
Deposit date:2002-03-06
Release date:2002-12-11
Last modified:2023-08-16
Method:X-RAY DIFFRACTION (2.8 Å)
Cite:Effects of deletion of streptokinase residues 48-59 on plasminogen activation.
PROTEIN ENG., 15, 2002
3MX0
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BU of 3mx0 by Molmil
Crystal Structure of EphA2 ectodomain in complex with ephrin-A5
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, Ephrin type-A receptor 2, ...
Authors:Himanen, J.P, Yermekbayeva, L, Janes, P.W, Walker, J.R, Xu, K, Atapattu, L, Rajashankar, K.R, Mensinga, A, Lackmann, M, Nikolov, D.B, Dhe-Paganon, S.
Deposit date:2010-05-06
Release date:2010-06-30
Last modified:2020-07-29
Method:X-RAY DIFFRACTION (3.506 Å)
Cite:Architecture of Eph receptor clusters.
Proc.Natl.Acad.Sci.USA, 107, 2010
5ZJD
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BU of 5zjd by Molmil
Lactate dehydrogenase with NADH and MLA
Descriptor: 1,4-DIHYDRONICOTINAMIDE ADENINE DINUCLEOTIDE, L-lactate dehydrogenase A chain, MALONATE ION
Authors:Han, C.W, Jang, S.B.
Deposit date:2018-03-20
Release date:2019-07-24
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (2.394 Å)
Cite:Machilin A Inhibits Tumor Growth and Macrophage M2 Polarization Through the Reduction of Lactic Acid.
Cancers (Basel), 11, 2019
7ZEQ
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BU of 7zeq by Molmil
Apo crystal structure of beta-xylosidase from Thermotoga maritima
Descriptor: (4S)-2-METHYL-2,4-PENTANEDIOL, Beta-xylosidase
Authors:Gloster, T.M, Foltanyi, F.
Deposit date:2022-03-31
Release date:2023-04-19
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (1.89 Å)
Cite:Structural and further functional characterisation of a glycoside hydrolase family 3 beta-xylosidase from Thermotoga maritima
To be published
7ZCY
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BU of 7zcy by Molmil
Sporosarcina pasteurii urease (SPU) co-crystallized in the presence of an Ebselen-derivative and bound to Se atoms
Descriptor: 1,2-ETHANEDIOL, HYDROXIDE ION, N-(2-chloranyl-4-fluoranyl-phenyl)-2-selanyl-benzamide, ...
Authors:Mazzei, L, Ciurli, S, Cianci, M.
Deposit date:2022-03-29
Release date:2023-04-19
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (1.54 Å)
Cite:Optimized Ebselen-Based Inhibitors of Bacterial Ureases with Nontypical Mode of Action.
J.Med.Chem., 66, 2023
1RLF
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BU of 1rlf by Molmil
STRUCTURE DETERMINATION OF THE RAS-BINDING DOMAIN OF THE RAL-SPECIFIC GUANINE NUCLEOTIDE EXCHANGE FACTOR RLF, NMR, 10 STRUCTURES
Descriptor: RLF
Authors:Esser, D, Bauer, B, Wolthuis, R.M.F, Wittinghofer, A, Cool, R.H, Bay, P.
Deposit date:1998-07-09
Release date:1999-02-16
Last modified:2024-05-22
Method:SOLUTION NMR
Cite:Structure determination of the Ras-binding domain of the Ral-specific guanine nucleotide exchange factor Rlf.
Biochemistry, 37, 1998
8OI9
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BU of 8oi9 by Molmil
Trichomonas vaginalis riboside hydrolase in complex with 5-methyluridine
Descriptor: 5-methyluridine, CALCIUM ION, Inosine-uridine preferring nucleoside hydrolase family protein, ...
Authors:Patrone, M, Stockman, B.J, Degano, M.
Deposit date:2023-03-22
Release date:2023-08-02
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:A riboside hydrolase that salvages both nucleobases and nicotinamide in the auxotrophic parasite Trichomonas vaginalis.
J.Biol.Chem., 299, 2023
6W29
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BU of 6w29 by Molmil
Trypanosoma cruzi Malic Enzyme in complex with inhibitor (MEC013)
Descriptor: 3,5-bis(fluoranyl)-~{N}-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]benzamide, 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, CITRIC ACID, ...
Authors:Mercaldi, G.F, Fagundes, M, Faria, J.N, Cordeiro, A.T.
Deposit date:2020-03-05
Release date:2021-03-10
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (2.14 Å)
Cite:Trypanosoma cruzi Malic Enzyme Is the Target for Sulfonamide Hits from the GSK Chagas Box.
Acs Infect Dis., 7, 2021
8OIA
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BU of 8oia by Molmil
Trichomonas vaginalis riboside hydrolase in complex with D-ribose
Descriptor: CALCIUM ION, GLYCEROL, Inosine-uridine preferring nucleoside hydrolase family protein, ...
Authors:Patrone, M, Stockman, B.J, Degano, M.
Deposit date:2023-03-22
Release date:2023-08-02
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:A riboside hydrolase that salvages both nucleobases and nicotinamide in the auxotrophic parasite Trichomonas vaginalis.
J.Biol.Chem., 299, 2023
8OIC
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BU of 8oic by Molmil
Trichomonas vaginalis riboside hydrolase (His-tagged)
Descriptor: BICINE, CALCIUM ION, Inosine-uridine preferring nucleoside hydrolase family protein
Authors:Patrone, M, Stockman, B.J, Degano, M.
Deposit date:2023-03-22
Release date:2023-08-02
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (2.8 Å)
Cite:A riboside hydrolase that salvages both nucleobases and nicotinamide in the auxotrophic parasite Trichomonas vaginalis.
J.Biol.Chem., 299, 2023
6W2N
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BU of 6w2n by Molmil
Trypanosoma cruzi Malic Enzyme in complex with inhibitor (MEC009)
Descriptor: 3,5-bis(fluoranyl)-~{N}-[3-[(2-fluoranyl-4-methoxy-phenyl)sulfamoyl]phenyl]benzamide, 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, CITRIC ACID, ...
Authors:Mercaldi, G.F, Fagundes, M, Faria, J.N, Cordeiro, A.T.
Deposit date:2020-03-06
Release date:2021-03-10
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (1.88 Å)
Cite:Trypanosoma cruzi Malic Enzyme Is the Target for Sulfonamide Hits from the GSK Chagas Box.
Acs Infect Dis., 7, 2021
8E5U
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BU of 8e5u by Molmil
Co-crystal structure of Chaetomium glucosidase with compound 9
Descriptor: (2R,3R,4R,5S)-2-(hydroxymethyl)-1-(6-{2-nitro-4-[(1R,5S)-3-oxa-8-azabicyclo[3.2.1]octan-8-yl]anilino}hexyl)piperidine-3,4,5-triol, 2-[BIS-(2-HYDROXY-ETHYL)-AMINO]-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, 2-acetamido-2-deoxy-beta-D-glucopyranose, ...
Authors:Karade, S.S, Mariuzza, R.A.
Deposit date:2022-08-22
Release date:2023-02-22
Last modified:2023-10-25
Method:X-RAY DIFFRACTION (2.33 Å)
Cite:Structure-Based Design of Potent Iminosugar Inhibitors of Endoplasmic Reticulum alpha-Glucosidase I with Anti-SARS-CoV-2 Activity.
J.Med.Chem., 66, 2023
5B05
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BU of 5b05 by Molmil
Lysozyme (control experiment)
Descriptor: 1,2-ETHANEDIOL, CHLORIDE ION, Lysozyme C, ...
Authors:Kita, A, Morimoto, Y.
Deposit date:2015-10-28
Release date:2016-01-13
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:An Effective Deuterium Exchange Method for Neutron Crystal Structure Analysis with Unfolding-Refolding Processes
Mol Biotechnol., 58, 2016
5ZO0
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BU of 5zo0 by Molmil
Neutron structure of xylanase at pD5.4
Descriptor: Endo-1,4-beta-xylanase 2
Authors:Wan, Q, Li, Z.H.
Deposit date:2018-04-12
Release date:2019-05-15
Last modified:2023-11-22
Method:NEUTRON DIFFRACTION (1.648 Å)
Cite:Neutron structure of xylanase at pD5.4
To be published
8E3J
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BU of 8e3j by Molmil
Co-crystal structure of Chaetomium glucosidase with compound 4
Descriptor: (2R,3R,4R,5S)-2-(hydroxymethyl)-1-{6-[2-nitro-4-(pyrimidin-2-yl)anilino]hexyl}piperidine-3,4,5-triol, 2-acetamido-2-deoxy-beta-D-glucopyranose, Chaetomium alpha glucosidase, ...
Authors:Karade, S.S, Mariuzza, R.A.
Deposit date:2022-08-17
Release date:2023-02-22
Last modified:2023-10-25
Method:X-RAY DIFFRACTION (2.71 Å)
Cite:Structure-Based Design of Potent Iminosugar Inhibitors of Endoplasmic Reticulum alpha-Glucosidase I with Anti-SARS-CoV-2 Activity.
J.Med.Chem., 66, 2023

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