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7EUA
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BU of 7eua by Molmil
X-ray crystal structure of a Monellin deletion construct carrying the P93A mutation
Descriptor: Monellin, SULFATE ION
Authors:Manjula, R, Bhatia, S, Jayant, B, Ramaswamy, S, Gosavi, S.
Deposit date:2021-05-16
Release date:2021-08-11
Last modified:2025-08-27
Method:X-RAY DIFFRACTION (2.43 Å)
Cite:X-ray crystal structure of a Monellin deletion construct carrying the P93A mutation
To Be Published
7KJM
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BU of 7kjm by Molmil
CRYSTAL STRUCTURE OF HUMAN MDM2 IN COMPLEX WITH D-PEPTIDE INHIBITOR (DPMI-OMEGA)
Descriptor: CHLORIDE ION, D-PMI-omega, DI(HYDROXYETHYL)ETHER, ...
Authors:Tolbert, W.D, Pazgier, M.
Deposit date:2020-10-26
Release date:2021-11-17
Last modified:2025-08-27
Method:X-RAY DIFFRACTION (1.4 Å)
Cite:A Dual-Specificity d-Peptide Antagonist of MDM2 and MDMX for Antitumor Immunotherapy.
J.Med.Chem., 2025
7KJN
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CRYSTAL STRUCTURE OF HUMAN MDMX IN COMPLEX WITH D-PEPTIDE INHIBITOR (DPMI-OMEGA)
Descriptor: D-PMI-omega, Protein Mdm4
Authors:Tolbert, W.D, Pazgier, M.
Deposit date:2020-10-26
Release date:2021-11-17
Last modified:2025-08-27
Method:X-RAY DIFFRACTION (2.8 Å)
Cite:A Dual-Specificity d-Peptide Antagonist of MDM2 and MDMX for Antitumor Immunotherapy.
J.Med.Chem., 2025
7QF6
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BU of 7qf6 by Molmil
N(5)-hydroxyornithine:cis-anhydromevalonyl coenzyme A-N(5)-transacylase sidF
Descriptor: GLYCEROL, N(5)-hydroxyornithine:cis-anhydromevalonyl coenzyme A-N(5)-transacylase sidF, POTASSIUM ION, ...
Authors:Poonsiri, T, Demitri, N, Stefano, B.
Deposit date:2021-12-03
Release date:2022-12-14
Last modified:2025-08-27
Method:X-RAY DIFFRACTION (1.87 Å)
Cite:SidF, a dual substrate N5-acetyl-N5-hydroxy-L-ornithine transacetylase involved in Aspergillus fumigatus siderophore biosynthesis.
J Struct Biol X, 11, 2025
7Y8J
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3D1 in complex with 6-mer HR1 peptide from SARS-CoV-2
Descriptor: Spike protein S2', heavy chain of 3D1, light chain of 3D1
Authors:Lei, Y.
Deposit date:2022-06-24
Release date:2023-07-12
Last modified:2025-08-27
Method:X-RAY DIFFRACTION (1.03 Å)
Cite:A broadly neutralizing antibody recognizes a unique epitope with a signature motif common across coronaviruses.
Nat Commun, 16, 2025
7YD3
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BU of 7yd3 by Molmil
Single-chain variable fragment of app 3D1 antibody
Descriptor: 1,2-ETHANEDIOL, CHLORIDE ION, DI(HYDROXYETHYL)ETHER, ...
Authors:Yan, L, Yang, G.
Deposit date:2022-07-03
Release date:2023-07-05
Last modified:2025-08-27
Method:X-RAY DIFFRACTION (2.16 Å)
Cite:A broadly neutralizing antibody recognizes a unique epitope with a signature motif common across coronaviruses
Nat Commun, 16, 2025
7YI6
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bnAb 3D1 in complex with 6-mer HR1 peptide from HCoV-229E S protein
Descriptor: 1,2-ETHANEDIOL, CHLORIDE ION, DI(HYDROXYETHYL)ETHER, ...
Authors:Yan, L, Yang, G.
Deposit date:2022-07-15
Release date:2023-08-30
Last modified:2025-08-27
Method:X-RAY DIFFRACTION (2.28 Å)
Cite:A broadly neutralizing antibody recognizes a unique epitope with a signature motif common across coronaviruses.
Nat Commun, 16, 2025
8B4T
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BU of 8b4t by Molmil
Human cathepsin B in complex with the carbamate inhibitor 7
Descriptor: (2S)-2-[[(2S)-2-[(4-chloranylphenoxy)carbonylamino]-3-cyclohexyl-propanoyl]amino]-3-phenyl-propanoic acid, Cathepsin B
Authors:Rubesova, P, Guetschow, M, Mares, M.
Deposit date:2022-09-21
Release date:2023-10-04
Last modified:2025-08-27
Method:X-RAY DIFFRACTION (1.45 Å)
Cite:Redirecting the Peptide Cleavage Causes Protease Inactivation.
Angew.Chem.Int.Ed.Engl., 64, 2025
8B5F
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Human cathepsin B in complex with the carbamate inhibitor 31
Descriptor: (2S)-2-[[(2S)-2-[[3-chloranyl-4-[[3-phenyl-2-(phenylmethyl)propanoyl]amino]phenoxy]carbonylamino]-3-cyclohexyl-propanoyl]amino]-3-phenyl-propanoic acid, 1,2-ETHANEDIOL, Cathepsin B
Authors:Rubesova, P, Guetschow, M, Mares, M.
Deposit date:2022-09-22
Release date:2023-10-04
Last modified:2025-08-27
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Redirecting the Peptide Cleavage Causes Protease Inactivation.
Angew.Chem.Int.Ed.Engl., 64, 2025
8E6O
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BU of 8e6o by Molmil
Crystal structure of human GCN5 histone acetyltransferase domain
Descriptor: Histone acetyltransferase KAT2A, S-{(3S,5R,9R)-1-[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)oxolan-2-yl]-3,5,9-trihydroxy-8,8-dimethyl-3,5,10,14-tetraoxo-2,4,6-trioxa-11,15-diaza-3lambda~5~,5lambda~5~-diphosphaheptadecan-17-yl} (2R)-2-hydroxypropanethioate
Authors:Lu, X.T, Tao, Y.J.
Deposit date:2022-08-23
Release date:2024-02-28
Last modified:2025-08-27
Method:X-RAY DIFFRACTION (2.37 Å)
Cite:ACSS2 acts as a lactyl-CoA synthetase and couples KAT2A to function as a lactyltransferase for histone lactylation and tumor immune evasion.
Cell Metab., 37, 2025
8G4A
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BU of 8g4a by Molmil
Human ARNT PAS-B complexed with KG-548 small molecule
Descriptor: 5-[3,5-bis(trifluoromethyl)phenyl]-2H-tetrazole, Aryl hydrocarbon receptor nuclear translocator
Authors:Xu, X, Isiorho, E.A, Pimentel Marcelino, L, Gardner, K.H.
Deposit date:2023-02-08
Release date:2024-02-14
Last modified:2025-08-27
Method:X-RAY DIFFRACTION (1.97 Å)
Cite:Use of High Pressure NMR Spectroscopy to Rapidly Identify Proteins with Internal Ligand-Binding Voids
Biorxiv, 2023
8QH5
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BU of 8qh5 by Molmil
CryoEM structure of UVSSA(VHS)-CSA-DDB1-DDA1
Descriptor: DET1- and DDB1-associated protein 1, DNA damage-binding protein 1, DNA excision repair protein ERCC-8, ...
Authors:Lee, S.-H, Sixma, T.K.
Deposit date:2023-09-06
Release date:2024-08-14
Last modified:2025-08-27
Method:ELECTRON MICROSCOPY (3.4 Å)
Cite:The small CRL4 CSA ubiquitin ligase component DDA1 regulates transcription-coupled repair dynamics.
Nat Commun, 15, 2024
8RQZ
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BU of 8rqz by Molmil
Crystal structure of Molybdenum bispyranopterin guanine dinucleotide formate dehydrogenases ForCE1 from Bacillus subtilis
Descriptor: 1,2-DIPALMITOYL-PHOSPHATIDYL-GLYCEROLE, 2-AMINO-5,6-DIMERCAPTO-7-METHYL-3,7,8A,9-TETRAHYDRO-8-OXA-1,3,9,10-TETRAAZA-ANTHRACEN-4-ONE GUANOSINE DINUCLEOTIDE, FE2/S2 (INORGANIC) CLUSTER, ...
Authors:Cherrier, M.V, Arnoux, P, Martin, L, Nicolet, Y, Schoehn, G, Legrand, P, Broc, M, Seduk, F, Brasseur, G, Arias-Cartin, R, Magalon, A, Walburger, A, Uzel, A, Guigliarelli, B, Grimaldi, S, Pierrel, F, Mate, M.
Deposit date:2024-01-22
Release date:2025-08-06
Last modified:2025-08-27
Method:X-RAY DIFFRACTION (2.694 Å)
Cite:A scaffold for quinone channeling between membrane and soluble bacterial oxidoreductases
Nat.Struct.Mol.Biol., 2025
8RR0
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BU of 8rr0 by Molmil
CryoEM structure of Molybdenum bispyranopterin guanine dinucleotide formate dehydrogenases ForCE1 from Bacillus subtilis
Descriptor: 2-AMINO-5,6-DIMERCAPTO-7-METHYL-3,7,8A,9-TETRAHYDRO-8-OXA-1,3,9,10-TETRAAZA-ANTHRACEN-4-ONE GUANOSINE DINUCLEOTIDE, FE2/S2 (INORGANIC) CLUSTER, HEPTANOIC ACID, ...
Authors:Cherrier, M.V, Arnoux, P, Martin, L, Nicolet, Y, Schoehn, G, Legrand, P, Broc, M, Seduk, F, Brasseur, G, Arias-Cartin, R, Magalon, A, Walburger, A, Uzel, A, Guigliarelli, B, Grimaldi, S, Pierrel, F, Mate, M.
Deposit date:2024-01-22
Release date:2025-08-06
Last modified:2025-08-27
Method:ELECTRON MICROSCOPY (3.35 Å)
Cite:A scaffold for quinone channeling between membrane and soluble bacterial oxidoreductases
Nat.Struct.Mol.Biol., 2025
8RV3
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BU of 8rv3 by Molmil
Structure of the domain IV of the replication factor RctB from Vibrio cholerae
Descriptor: GLYCEROL, IODIDE ION, RctB
Authors:Garcia-Pino, A, Talavera Perez, A.
Deposit date:2024-01-31
Release date:2025-02-12
Last modified:2025-08-27
Method:X-RAY DIFFRACTION (2.35 Å)
Cite:Dynamic transitions of initiator binding coordinate the replication of the two chromosomes in Vibrio cholerae.
Nat Commun, 16, 2025
8RVG
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BU of 8rvg by Molmil
Structure of the binding domain of BoNT/A mutant Y1117V in complex with the GD1a ganglioside receptor
Descriptor: Botulinum neurotoxin A heavy chain, N-acetyl-alpha-neuraminic acid-(2-3)-beta-D-galactopyranose-(1-3)-2-acetamido-2-deoxy-beta-D-galactopyranose-(1-4)-beta-D-galactopyranose
Authors:Masuyer, G, Stenmark, P.
Deposit date:2024-02-01
Release date:2025-02-12
Last modified:2025-08-27
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Botulinum neurotoxin A mutants with enhanced ganglioside binding show improved potency and altered ganglioside selectivity.
Commun Chem, 8, 2025
8RVH
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BU of 8rvh by Molmil
Structure of the binding domain of BoNT/A mutant Y1117V/H1253K in complex with the GD1a ganglioside receptor
Descriptor: Botulinum neurotoxin A heavy chain, N-acetyl-alpha-neuraminic acid, beta-D-galactopyranose-(1-3)-2-acetamido-2-deoxy-beta-D-galactopyranose-(1-4)-beta-D-galactopyranose-(1-4)-beta-D-glucopyranose
Authors:Masuyer, G, Stenmark, P.
Deposit date:2024-02-01
Release date:2025-02-12
Last modified:2025-08-27
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Botulinum neurotoxin A mutants with enhanced ganglioside binding show improved potency and altered ganglioside selectivity.
Commun Chem, 8, 2025
8RVI
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BU of 8rvi by Molmil
Structure of the binding domain of BoNT/A mutant H1253K in complex with the GM1a ganglioside receptor
Descriptor: Botulinum neurotoxin A heavy chain, beta-D-galactopyranose-(1-3)-2-acetamido-2-deoxy-beta-D-galactopyranose-(1-4)-[N-acetyl-alpha-neuraminic acid-(2-3)]beta-D-galactopyranose
Authors:Masuyer, G, Stenmark, P.
Deposit date:2024-02-01
Release date:2025-02-12
Last modified:2025-08-27
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:Botulinum neurotoxin A mutants with enhanced ganglioside binding show improved potency and altered ganglioside selectivity.
Commun Chem, 8, 2025
8RVU
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CryoEM structure of the Elp-Hdr complex of Methanothermobacter marburgensis state 2 (composite structure)
Descriptor: FE2/S2 (INORGANIC) CLUSTER, FLAVIN-ADENINE DINUCLEOTIDE, Formate dehydrogenase, ...
Authors:San Segundo-Acosta, P, Murphy, B.J.
Deposit date:2024-02-02
Release date:2025-05-14
Last modified:2025-08-27
Method:ELECTRON MICROSCOPY (2.22 Å)
Cite:Electron flow in hydrogenotrophic methanogens under nickel limitation.
Nature, 644, 2025
8RVV
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BU of 8rvv by Molmil
CryoEM structure of the Elp-Hdr complex of Methanothermobacter marburgensis state 2, dimer (composite structure)
Descriptor: FE2/S2 (INORGANIC) CLUSTER, FLAVIN-ADENINE DINUCLEOTIDE, Formate dehydrogenase, ...
Authors:San Segundo-Acosta, P, Murphy, B.J.
Deposit date:2024-02-15
Release date:2025-05-14
Last modified:2025-08-27
Method:ELECTRON MICROSCOPY (2.2 Å)
Cite:Electron flow in hydrogenotrophic methanogens under nickel limitation.
Nature, 644, 2025
8RVY
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BU of 8rvy by Molmil
CryoEM structure of the Elp-Hdr complex of Methanothermobacter marburgensis state 1 (composite structure)
Descriptor: FE2/S2 (INORGANIC) CLUSTER, FLAVIN-ADENINE DINUCLEOTIDE, Formate dehydrogenase, ...
Authors:San Segundo-Acosta, P, Murphy, B.J.
Deposit date:2024-02-02
Release date:2025-05-14
Last modified:2025-08-27
Method:ELECTRON MICROSCOPY (2.36 Å)
Cite:Electron flow in hydrogenotrophic methanogens under nickel limitation.
Nature, 644, 2025
8RWN
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BU of 8rwn by Molmil
CryoEM structure of the Hdr(ABC)2 subunits of the Elp-Hdr complex of Methanothermobacter marburgensis
Descriptor: FLAVIN-ADENINE DINUCLEOTIDE, H(2):CoB-CoM heterodisulfide,ferredoxin reductase subunit A, H(2):CoB-CoM heterodisulfide,ferredoxin reductase subunit B, ...
Authors:San Segundo-Acosta, P, Murphy, B.J.
Deposit date:2024-02-05
Release date:2025-05-14
Last modified:2025-08-27
Method:ELECTRON MICROSCOPY (1.85 Å)
Cite:Electron flow in hydrogenotrophic methanogens under nickel limitation.
Nature, 644, 2025
8TVT
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BU of 8tvt by Molmil
Structure of human Cysteine desulfurase Nfs1 with L-propargylglycine bound to active site PLP in complex with ISD11, Acp1 and ISCU2
Descriptor: 1,2-ETHANEDIOL, 2,3-DIHYDROXY-1,4-DITHIOBUTANE, 2,5,8,11,14,17-HEXAOXANONADECAN-19-OL, ...
Authors:Cygler, M, Boniecki, M.T.
Deposit date:2023-08-18
Release date:2024-09-11
Last modified:2025-08-27
Method:X-RAY DIFFRACTION (2 Å)
Cite:D-cysteine impairs tumour growth by inhibiting cysteine desulfurase NFS1.
Nat Metab, 2025
8U1P
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BU of 8u1p by Molmil
Local refinement of Plasmodium falciparum gametocyte surface protein Pfs48/45 Domains 1 and 2 in complex with neutralizing antibodies
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, Gametocyte surface protein P45/48, ...
Authors:Kucharska, I, Hailemariam, S, Ivanochko, D, Rubinstein, J, Julien, J.P.
Deposit date:2023-09-01
Release date:2025-03-12
Last modified:2025-08-27
Method:ELECTRON MICROSCOPY (3.3 Å)
Cite:Structural elucidation of full-length Pfs48/45 in complex with potent monoclonal antibodies isolated from a naturally exposed individual.
Nat.Struct.Mol.Biol., 32, 2025
8URM
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BU of 8urm by Molmil
E. coli 70S ribosome with unmodified tRNAPro(GGG) bound to slippery P-site CCC-C codon and tRNAVal(UAC) in the A site
Descriptor: 13S ribosomal RNA, 16S ribosomal RNA, 30S ribosomal protein S11, ...
Authors:Kimbrough, E.M, Dunham, C.M, Nguyen, H.A.
Deposit date:2023-10-26
Release date:2025-07-09
Last modified:2025-08-27
Method:ELECTRON MICROSCOPY (3 Å)
Cite:An RNA modification prevents extended codon-anticodon interactions from facilitating +1 frameshifting.
Nat Commun, 16, 2025

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