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9ENN
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BU of 9enn by Molmil
L-amino acid oxidase 4 (HcLAAO4) from the fungus Hebeloma cylindrosporum in complex with N-epsilon-acetyl-L-lysine
Descriptor: DIHYDROFLAVINE-ADENINE DINUCLEOTIDE, L-amino acid oxidase 4, N(6)-ACETYLLYSINE, ...
Authors:Gilzer, D, Koopmeiners, S, Fischer von Mollard, G, Niemann, H.H.
Deposit date:2024-03-13
Release date:2024-08-14
Last modified:2024-08-28
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Crystal structure and enzyme engineering of the broad substrate spectrum l-amino acid oxidase 4 from the fungus Hebeloma cylindrosporum.
Febs Lett., 2024
9G0K
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BU of 9g0k by Molmil
CysG(N-16) in complex with SAH (metal free, cocrystallization in presence of EDTA) from Kitasatospora cystarginea
Descriptor: 1,2-ETHANEDIOL, S-ADENOSYL-L-HOMOCYSTEINE, SAM-dependent methyltransferase
Authors:Kuttenlochner, W, Beller, P, Kaysser, L, Groll, M.
Deposit date:2024-07-08
Release date:2024-07-17
Last modified:2024-09-18
Method:X-RAY DIFFRACTION (2 Å)
Cite:Deciphering the SAM- and metal-dependent mechanism of O-methyltransferases in cystargolide and belactosin biosynthesis: A structure-activity relationship study.
J.Biol.Chem., 300, 2024
7ANZ
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BU of 7anz by Molmil
Structure of the Candida albicans gamma-Tubulin Small Complex
Descriptor: Spindle pole body component, Tubulin gamma chain
Authors:Zupa, E, Pfeffer, S.
Deposit date:2020-10-13
Release date:2020-11-04
Last modified:2024-05-01
Method:ELECTRON MICROSCOPY (3.6 Å)
Cite:The cryo-EM structure of a gamma-TuSC elucidates architecture and regulation of minimal microtubule nucleation systems.
Nat Commun, 11, 2020
9AVW
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BU of 9avw by Molmil
Structure of TAB2 NZF domain bound to K6 / Lys6-linked diubiquitin
Descriptor: SULFATE ION, TGF-beta-activated kinase 1 and MAP3K7-binding protein 2, Ubiquitin, ...
Authors:Michel, M.A, Scutts, S, Komander, D.
Deposit date:2024-03-05
Release date:2024-07-31
Method:X-RAY DIFFRACTION (1.747 Å)
Cite:Structure of TAB2 NZF domain bound to K6 / Lys6-linked diubiquitin
To be published
9FFD
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BU of 9ffd by Molmil
STRUCTURE OF ALDO-KETO REDUCTASE 1C3 (AKR1C3) IN COMPLEX WITH AN INHIBITOR MEDS765
Descriptor: 1,2-ETHANEDIOL, 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, Aldo-keto reductase family 1 member C3, ...
Authors:Frydenvang, K, Hussain, S, Mirza, O.A.
Deposit date:2024-05-23
Release date:2024-08-21
Last modified:2024-08-28
Method:X-RAY DIFFRACTION (1.75 Å)
Cite:AI Based Discovery of a New AKR1C3 Inhibitor for Anticancer Applications.
Acs Med.Chem.Lett., 15, 2024
9BVU
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BU of 9bvu by Molmil
NMR structure of TLP-2 in solution
Descriptor: Temporin-1Tl
Authors:Jia, R, McShan, A.C.
Deposit date:2024-05-20
Release date:2024-06-05
Method:SOLUTION NMR
Cite:Design and Development of Temporin L Analogues to Inhibit the Main Protease of SARS-CoV-2
To Be Published
9BXI
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BU of 9bxi by Molmil
Paired Helical Filament of tau amyloids found in Down Syndrome individuals
Descriptor: Microtubule-associated protein tau
Authors:Tse, E, Ghosh, U, Condello, C, Southworth, D.
Deposit date:2024-05-22
Release date:2024-08-14
Method:ELECTRON MICROSCOPY (2.7 Å)
Cite:Cryo-EM structures reveal tau filaments from Down syndrome adopt Alzheimer's disease fold.
Acta Neuropathol Commun, 12, 2024
9F5Q
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BU of 9f5q by Molmil
Crystal structure of selenomethionine-labelled kinetoplastid kinetochore protein KKT23 acetyltransferase domain from Trypanosoma brucei
Descriptor: ACETYL COENZYME *A, N-acetyltransferase domain-containing protein
Authors:Ludzia, P, Ishii, M, Akiyoshi, B.
Deposit date:2024-04-30
Release date:2024-08-28
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:The kinetoplastid kinetochore protein KKT23 acetyltransferase is a structural homolog of GCN5 that acetylates the histone H2A C-terminal tail
Biorxiv, 2024
7AHB
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BU of 7ahb by Molmil
Acyltransferase domain of the polyketide synthase PpsC of Mycobacterium tuberculosis
Descriptor: GLYCEROL, Phthiocerol synthesis polyketide synthase type I PpsC, SODIUM ION, ...
Authors:Faille, A, Mourey, L, Pedelacq, J.D.
Deposit date:2020-09-24
Release date:2020-12-09
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Molecular Basis for Extender Unit Specificity of Mycobacterial Polyketide Synthases.
Acs Chem.Biol., 15, 2020
9BG1
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BU of 9bg1 by Molmil
Tri-complex of Compound-3, KRAS G12V, and CypA
Descriptor: (2R)-N-[(1P,7S,9S,13R,20M)-21-ethyl-20-{2-[(1S)-1-methoxyethyl]pyridin-3-yl}-17,17-dimethyl-8,14-dioxo-15-oxa-4-thia-9,21,27,28-tetraazapentacyclo[17.5.2.1~2,5~.1~9,13~.0~22,26~]octacosa-1(24),2,5(28),19,22,25-hexaen-7-yl]-3-methyl-2-(N-methylacetamido)butanamide (non-preferred name), GTPase KRas, MAGNESIUM ION, ...
Authors:Tomlinson, A.C.A, Saldajeno-Concar, M, Knox, J.E, Yano, J.K.
Deposit date:2024-04-18
Release date:2024-06-12
Last modified:2024-06-26
Method:X-RAY DIFFRACTION (1.51 Å)
Cite:Tri-complex of Compound-3, KRAS G12V, and CypA
To be published
9GBV
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BU of 9gbv by Molmil
E.coli gyrase holocomplex with chirally wrapped 217 bp DNA fragment
Descriptor: DNA gyrase subunit A, DNA gyrase subunit B, MAGNESIUM ION, ...
Authors:Michalczyk, E, Ghilarov, D.
Deposit date:2024-07-31
Release date:2024-08-21
Method:ELECTRON MICROSCOPY (2.32 Å)
Cite:Structure of Escherichia coli DNA gyrase with chirally wrapped DNA supports ratchet-and-pawl mechanism for an ATP-powered supercoiling motor
Proceedings of the National Academy of Sciences USA, 2024
9FW2
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BU of 9fw2 by Molmil
SARS CoV-2 nsp10 in complex with the ExoN domain from nsp14
Descriptor: GLYCEROL, Guanine-N7 methyltransferase nsp14, Non-structural protein 11, ...
Authors:Fisher, S.Z.
Deposit date:2024-06-28
Release date:2024-07-10
Last modified:2024-07-17
Method:X-RAY DIFFRACTION (1.77 Å)
Cite:SARS CoV-2 nsp10 in complex with the ExoN domain from nsp14
To Be Published
9B0B
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BU of 9b0b by Molmil
Structure of Optineurin bound to HOIP NZF1 domain
Descriptor: E3 ubiquitin-protein ligase RNF31, Optineurin, TETRAETHYLENE GLYCOL, ...
Authors:Michel, M.A, Scutts, S, Komander, D.
Deposit date:2024-03-11
Release date:2024-07-31
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Linkage and substrate specificity conferred by NZF ubiquitin binding domains
To Be Published
9BTS
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BU of 9bts by Molmil
Crystal structure of the bacterioferritin (Bfr) and ferritin (Ftn) heterooligomer complex from Acinetobacter baumannii
Descriptor: Bacterioferritin (Bfr), Ferritin (Ftn), PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:Lovell, S, Liu, L, Battaile, K.P, Rivera, M.
Deposit date:2024-05-15
Release date:2024-08-14
Last modified:2024-08-21
Method:X-RAY DIFFRACTION (1.85 Å)
Cite:The crystal structure of Acinetobacter baumannii bacterioferritin reveals a heteropolymer of bacterioferritin and ferritin subunits.
Sci Rep, 14, 2024
7APL
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BU of 7apl by Molmil
tRNA-guanine transglycosylase G87C mutant spin-labeled with MTSL
Descriptor: GLYCEROL, Queuine tRNA-ribosyltransferase, ZINC ION
Authors:Nguyen, D, Heine, A, Klebe, G.
Deposit date:2020-10-18
Release date:2020-10-28
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.99 Å)
Cite:Unraveling a Ligand-Induced Twist of a Homodimeric Enzyme by Pulsed Electron-Electron Double Resonance.
Angew.Chem.Int.Ed.Engl., 60, 2021
9CRN
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BU of 9crn by Molmil
Crystal structure of Streptococcus pyogenes TglA
Descriptor: GLYCEROL, SODIUM ION, Transglutaminase-like domain-containing protein
Authors:Campbell, I.R, Neiditch, M.B.
Deposit date:2024-07-22
Release date:2024-08-14
Method:X-RAY DIFFRACTION (1.96 Å)
Cite:Crystal structure of Streptococcus pyogenes TglA
To Be Published
9B9M
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BU of 9b9m by Molmil
Crystal structure of iron-bound FlcD from Pseudomonas aeruginosa
Descriptor: FE (II) ION, Pyrroloquinoline quinone (Coenzyme PQQ) biosynthesis protein C
Authors:Walker, M.E, Grove, T.L, Li, B, Redinbo, M.R.
Deposit date:2024-04-02
Release date:2024-07-31
Last modified:2024-09-18
Method:X-RAY DIFFRACTION (2.07 Å)
Cite:Structural Basis for Methine Excision by a Heme Oxygenase-like Enzyme.
Acs Cent.Sci., 10, 2024
9D6J
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BU of 9d6j by Molmil
Nitrile hydratase BR52K mutant
Descriptor: Cobalt-containing nitrile hydratase subunit alpha, Cobalt-containing nitrile hydratase subunit beta
Authors:Miller, C.G, Holz, R.C, Liu, D, Kaley, N.
Deposit date:2024-08-15
Release date:2024-08-28
Method:X-RAY DIFFRACTION (1.47 Å)
Cite:Role of second-sphere arginine residues in metal binding and metallocentre assembly in nitrile hydratases.
J Inorg Biochem, 256, 2024
9CE9
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BU of 9ce9 by Molmil
Solution NMR structure of the fungal loosenin PcaLOOL12 from Phanerochaete carnosa
Descriptor: RlpA-like protein double-psi beta-barrel domain-containing protein
Authors:Buchko, G.W, Master, E.R.
Deposit date:2024-06-26
Release date:2024-07-10
Last modified:2024-07-17
Method:SOLUTION NMR
Cite:Bio-SANS investigation of fungal loosenins reveal substrate dependent impacts of protein action on inter-fibril distance and packing order of cellulosic substrates
To Be Published
4P1M
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BU of 4p1m by Molmil
The structure of Escherichia coli ZapA
Descriptor: CHLORIDE ION, Cell division protein ZapA
Authors:Kimber, M.S, Roach, E.J, Khursigara, C.M.
Deposit date:2014-02-26
Release date:2014-07-16
Last modified:2023-09-27
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:Crystal Structure and Site-directed Mutational Analysis Reveals Key Residues Involved in Escherichia coli ZapA Function.
J.Biol.Chem., 289, 2014
9GII
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BU of 9gii by Molmil
Jumonji domain-containing protein 2A with crystallization epitope mutation R913A
Descriptor: GLYCEROL, Lysine-specific demethylase 4A, SULFATE ION
Authors:Fairhead, M, Strain-Damerell, C, Ye, M, Mackinnon, S.R, Pinkas, D, MacLean, E.M, Koekemoer, L, Damerell, D, Krojer, T, Arrowsmith, C.H, Edwards, A, Bountra, C, Yue, W, Burgess-Brown, N, Marsden, B, von Delft, F, Structural Genomics Consortium (SGC)
Deposit date:2024-08-19
Release date:2024-09-04
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:A fast, parallel method for efficiently exploring crystallization behaviour of large numbers of protein variants
To be published
9BHW
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BU of 9bhw by Molmil
Septin Tetrameric Complex SEPT7/SEPT9 of Ciona intestinalis by Cryo-EM
Descriptor: CiSeptin-7, GUANOSINE-5'-DIPHOSPHATE, Neuronal-specific septin-3
Authors:Mendonca, D.C, Pereira, H.M, Garratt, R.C.
Deposit date:2024-04-22
Release date:2024-07-10
Last modified:2024-07-24
Method:ELECTRON MICROSCOPY (2.72 Å)
Cite:Structural Insights into Ciona intestinalis Septins: Complexes Suggest a Mechanism for Nucleotide-dependent Interfacial Cross-talk.
J.Mol.Biol., 436, 2024
9C6N
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BU of 9c6n by Molmil
ARP module of the human TIP60 complex
Descriptor: ADENOSINE-5'-TRIPHOSPHATE, Actin, cytoplasmic 1, ...
Authors:Yang, Z, Mameri, A, Florez Ariza, A.J, Cote, J, Nogales, E.
Deposit date:2024-06-07
Release date:2024-08-21
Last modified:2024-09-11
Method:ELECTRON MICROSCOPY (3.29 Å)
Cite:Structural insights into the human NuA4/TIP60 acetyltransferase and chromatin remodeling complex.
Science, 385, 2024
9FQA
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BU of 9fqa by Molmil
Crystal structure of SARS-CoV-2 main protease (MPro) in complex with the covalently bound inhibitor PSB-21101 (compound 30b in publication)
Descriptor: (5-chloranylpyridin-3-yl) 2-fluoranyl-4-phenylmethoxy-benzoate, BROMIDE ION, MAGNESIUM ION, ...
Authors:Strater, N, Claff, T, Sylvester, K, Oneto, A, Guetschow, M, Mueller, C.E.
Deposit date:2024-06-14
Release date:2024-08-28
Last modified:2024-09-25
Method:X-RAY DIFFRACTION (1.47 Å)
Cite:Nonpeptidic Irreversible Inhibitors of SARS-CoV-2 Main Protease with Potent Antiviral Activity.
J.Med.Chem., 67, 2024
9GJ2
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BU of 9gj2 by Molmil
Crystal structure of human cathepsin S produced in insect cells in complex with ketoamide 13b
Descriptor: 1,2-ETHANEDIOL, CITRIC ACID, Cathepsin S, ...
Authors:Falke, S, Karnicar, K, Usenik, A, Lindic, N, Sekirnik, A, Reinke, P.Y.A, Guenther, S, Turk, D, Meents, A.
Deposit date:2024-08-20
Release date:2024-09-04
Method:X-RAY DIFFRACTION (1.15 Å)
Cite:Crystal structure of human cathepsin S produced in insect cells in complex with ketoamide 13b
To Be Published

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PDB entries from 2024-09-25

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