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9BHN
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BU of 9bhn by Molmil
Solution NMR structure of halichondamide A, a fused bicyclic cysteine knot undecapeptide from the marine sponge Halichondria bowerbanki
Descriptor: Halichondamide A
Authors:Agarwal, V, McShan, A.C, Zhong, W.
Deposit date:2024-04-21
Release date:2024-08-21
Last modified:2024-09-25
Method:SOLUTION NMR
Cite:Discovery and Folding Dynamics of a Fused Bicyclic Cysteine Knot Undecapeptide from the Marine Sponge Halichondria bowerbanki.
J.Org.Chem., 89, 2024
9B1M
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BU of 9b1m by Molmil
Pyrazinoate bound human URAT1 in the inward-facing state (site1)
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, PYRAZINE-2-CARBOXYLIC ACID, Solute carrier family 22 member 12
Authors:Dai, Y, Lee, C.H.
Deposit date:2024-03-13
Release date:2024-09-18
Method:ELECTRON MICROSCOPY (3 Å)
Cite:Transport mechanism and structural pharmacology of human urate transporter URAT1.
Cell Res., 2024
8YRP
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BU of 8yrp by Molmil
SARS-CoV-2 Delta Spike in complex with JM-1A
Descriptor: JM-1A Heavy Chain, JM-1A Light Chain, Spike glycoprotein
Authors:Nguyen, V.H.T, Chen, X.
Deposit date:2024-03-21
Release date:2024-06-05
Last modified:2024-06-26
Method:ELECTRON MICROSCOPY (3.64 Å)
Cite:The presence of broadly neutralizing anti-SARS-CoV-2 RBD antibodies elicited by primary series and booster dose of COVID-19 vaccine.
Plos Pathog., 20, 2024
9FH9
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BU of 9fh9 by Molmil
Structure of CyclinB1 N-terminus bound to the NCP
Descriptor: DNA (145-MER), G2/mitotic-specific cyclin-B1, Histone H2A type 3, ...
Authors:Young, R.V.C, Muhammad, R, Alfieri, C.
Deposit date:2024-05-27
Release date:2024-07-24
Last modified:2024-08-28
Method:ELECTRON MICROSCOPY (2.5 Å)
Cite:Spatial control of the APC/C ensures the rapid degradation of cyclin B1.
Embo J., 2024
9FEF
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BU of 9fef by Molmil
Cryo-EM structure of Trypanosoma cruzi (MDH)4-PEX5 complex
Descriptor: Peroxisome targeting signal 1 receptor, malate dehydrogenase
Authors:Lipinski, O, Sonani, R.R, Blat, A, Jemiola-Rzeminska, M, Patel, S.N, Sood, T, Dubin, G.
Deposit date:2024-05-19
Release date:2024-05-29
Method:ELECTRON MICROSCOPY (2.98 Å)
Cite:Cryo-EM structure of Trypanosoma cruzi (MDH)4-PEX5 complex
To Be Published
9FCJ
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BU of 9fcj by Molmil
USP1 bound to ML323 and ubiquitin conjugated to FANCD2 (ordered subset, focused refinement)
Descriptor: 5-methyl-2-(2-propan-2-ylphenyl)-~{N}-[[4-(1,2,3-triazol-1-yl)phenyl]methyl]pyrimidin-4-amine, Polyubiquitin-C, Ubiquitin carboxyl-terminal hydrolase 1, ...
Authors:Rennie, M.L, Gundogdu, M, Walden, H.
Deposit date:2024-05-15
Release date:2024-09-04
Last modified:2024-09-25
Method:ELECTRON MICROSCOPY (2.7 Å)
Cite:Structural and Biochemical Insights into the Mechanism of Action of the Clinical USP1 Inhibitor, KSQ-4279.
J.Med.Chem., 67, 2024
9FJU
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BU of 9fju by Molmil
Structure of the DNase I- and phalloidin-bound pointed end of F-actin (conformer 1)
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, ADENOSINE-5'-DIPHOSPHATE, Actin, ...
Authors:Boiero Sanders, M, Oosterheert, W, Hofnagel, O, Bieling, P, Raunser, S.
Deposit date:2024-05-31
Release date:2024-09-11
Last modified:2024-10-02
Method:ELECTRON MICROSCOPY (3.84 Å)
Cite:Phalloidin and DNase I-bound F-actin pointed end structures reveal principles of filament stabilization and disassembly.
Nat Commun, 15, 2024
8ZBA
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BU of 8zba by Molmil
CryoEM structure of non-structural protein 1 tetramer from Yellow Fever Virus
Descriptor: Non-structural protein 1
Authors:Pan, Q, Chen, Q, Hu, H.L.
Deposit date:2024-04-26
Release date:2024-09-11
Method:ELECTRON MICROSCOPY (3.57 Å)
Cite:Structural Insights into the Dynamic Assembly of a YFV sNS1 Tetramer.
Viruses, 16, 2024
9F9Y
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BU of 9f9y by Molmil
SARS-CoV-2 BA-2.87.1 Spike ectodomain
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, Spike glycoprotein,Fibritin
Authors:Ren, J, Stuart, D.I, Duyvesteyn, H.M.E.
Deposit date:2024-05-09
Release date:2024-08-21
Last modified:2024-09-04
Method:ELECTRON MICROSCOPY (2.8 Å)
Cite:Concerted deletions eliminate a neutralizing supersite in SARS-CoV-2 BA.2.87.1 spike.
Structure, 2024
9C6Q
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BU of 9c6q by Molmil
Structure of V. cholerae monomeric DdmD bound with ssDNA
Descriptor: Helicase/UvrB N-terminal domain-containing protein, ssDNA
Authors:Shen, Z.F, Yang, X.Y, Fu, T.M.
Deposit date:2024-06-08
Release date:2024-08-21
Last modified:2024-10-02
Method:ELECTRON MICROSCOPY (3.18 Å)
Cite:DdmDE eliminates plasmid invasion by DNA-guided DNA targeting.
Cell, 187, 2024
9GG6
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BU of 9gg6 by Molmil
P301T type II tau filaments from human brain
Descriptor: Isoform Tau-F of Microtubule-associated protein tau
Authors:Schweighauser, M, Shi, Y, Murzin, A.G, Garringer, H.J, Vidal, R, Murrell, J.R, Erro, M.E, Seelaar, H, Ferrer, I, van Swieten, J.C, Ghetti, B, Scheres, S.H.W, Goedert, M.
Deposit date:2024-08-13
Release date:2024-09-11
Method:ELECTRON MICROSCOPY (3.36 Å)
Cite:Novel tau filament folds in individuals with MAPT mutations P301L and P301T.
Biorxiv, 2024
9BK2
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BU of 9bk2 by Molmil
Crystal structure of Lactate dehydrogenase in complex with 4-((4-(1-methyl-1H-imidazole-2-carbonyl)phenyl)amino)-4-oxo-2-(4-(trifluoromethyl)phenyl)butanoic acid (S-enantiomer, monoclinic P form)
Descriptor: (2S)-4-[4-(1-methyl-1H-imidazole-2-carbonyl)anilino]-4-oxo-2-[4-(trifluoromethyl)phenyl]butanoic acid, DIMETHYL SULFOXIDE, L-lactate dehydrogenase A chain, ...
Authors:Lovell, S, Cooper, A, Battaile, K.P, Sharma, H.
Deposit date:2024-04-26
Release date:2024-07-10
Last modified:2024-09-04
Method:X-RAY DIFFRACTION (1.85 Å)
Cite:Synthesis and biological characterization of an orally bioavailable lactate dehydrogenase-A inhibitor against pancreatic cancer.
Eur.J.Med.Chem., 275, 2024
9AT8
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BU of 9at8 by Molmil
Fab 77-stabilized MeV F ectodomain fragment
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, Fusion glycoprotein F0, mAB 77 heavy chain, ...
Authors:Zyla, D, Saphire, E.O.
Deposit date:2024-02-26
Release date:2024-07-03
Last modified:2024-07-24
Method:ELECTRON MICROSCOPY (3.6 Å)
Cite:A neutralizing antibody prevents postfusion transition of measles virus fusion protein.
Science, 384, 2024
9FCI
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BU of 9fci by Molmil
USP1 bound to KSQ-4279 and ubiquitin conjugated to FANCD2 (focused refinement)
Descriptor: 6-(4-cyclopropyl-6-methoxy-pyrimidin-5-yl)-1-[[4-[1-propan-2-yl-4-(trifluoromethyl)imidazol-2-yl]phenyl]methyl]pyrazolo[3,4-d]pyrimidine, Polyubiquitin-C, Ubiquitin carboxyl-terminal hydrolase 1, ...
Authors:Rennie, M.L, Gundogdu, M, Walden, H.
Deposit date:2024-05-15
Release date:2024-09-04
Last modified:2024-09-25
Method:ELECTRON MICROSCOPY (3.2 Å)
Cite:Structural and Biochemical Insights into the Mechanism of Action of the Clinical USP1 Inhibitor, KSQ-4279.
J.Med.Chem., 67, 2024
9FTG
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BU of 9ftg by Molmil
Closed conformation of the pentameric ligand-gated ion channel, DeCLIC at pH 5 with 10 mM Ca2+
Descriptor: CALCIUM ION, Neurotransmitter-gated ion-channel ligand-binding domain-containing protein
Authors:Rovsnik, U, Anden, O, Lycksell, M, Delarue, M, Howard, R.J, Lindahl, E.
Deposit date:2024-06-24
Release date:2024-09-11
Method:ELECTRON MICROSCOPY (3.1 Å)
Cite:Structural characterization of pH-modulated closed and open states in a pentameric ligand-gated ion channel
To Be Published
9CBM
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BU of 9cbm by Molmil
Cryo-EM structure of dexmedetomidine-bound alpha-2A-adrenergic receptor in complex with heterotrimeric Gi-protein
Descriptor: 4-[(1~{S})-1-(2,3-dimethylphenyl)ethyl]-1~{H}-imidazole, Endolysin,Alpha-2A adrenergic receptor, Guanine nucleotide-binding protein G(I)/G(S)/G(O) subunit gamma-2, ...
Authors:Lou, J.S, Su, M, Wang, J, Do, H.N, Miao, Y, Huang, X.Y.
Deposit date:2024-06-19
Release date:2024-09-11
Method:ELECTRON MICROSCOPY (3.2 Å)
Cite:Distinct binding conformations of epinephrine with alpha- and beta-adrenergic receptors.
Exp.Mol.Med., 2024
8ZHI
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BU of 8zhi by Molmil
SARS-CoV-2 spike trimer (6P) in complex with three H18 Fabs
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, Heavy chain of H18 Fab, ...
Authors:Yan, Q, Gao, X, Liu, B, Hou, R, He, P, Li, Z, Chen, Q, Wang, J, He, J, Chen, L, Zhao, J, Xiong, X.
Deposit date:2024-05-11
Release date:2024-08-21
Method:ELECTRON MICROSCOPY (6.05 Å)
Cite:Antibodies utilizing VL6-57 light chains target a convergent cryptic epitope on SARS-CoV-2 spike protein helping to drive the genesis of Omicron variants
To Be Published
9D9L
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BU of 9d9l by Molmil
Mycobacteriophage Bxb1 tail tube segment - Composite map and model
Descriptor: Major tail protein
Authors:Freeman, K.G.
Deposit date:2024-08-21
Release date:2024-09-25
Method:ELECTRON MICROSCOPY (4 Å)
Cite:Structure and infection dynamics of mycobacteriophage Bxb1
To Be Published
8ZUG
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BU of 8zug by Molmil
Human Keratin 19 head domain segment Y6-G28 in solution
Descriptor: Keratin, type I cytoskeletal 19
Authors:Ji, Y, Jeong, M, Kim, J, Lee, C.H.
Deposit date:2024-06-09
Release date:2024-08-21
Method:SOLUTION NMR
Cite:Human Keratin 19 head domain segment Y6-G28 in solution
To Be Published
9DE2
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BU of 9de2 by Molmil
ETO2 MYND bound to MPPL peptide from GATAD2A
Descriptor: GATAD2A-MPPL motif and ETO2 NHR4 domain fusion protein, ZINC ION
Authors:Williams, D.C.
Deposit date:2024-08-28
Release date:2024-09-18
Method:SOLUTION NMR
Cite:The role of multivalency in the association of the eight twenty-one protein 2 (ETO2) with the nucleosome remodeling and deacetylase (NuRD) complex
To Be Published
9D93
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BU of 9d93 by Molmil
Mycobacteriophage Bxb1 tail tip - Composite map and model
Descriptor: Major tail protein, Minor tail protein, Tapemeasure protein
Authors:Freeman, K.G.
Deposit date:2024-08-20
Release date:2024-09-25
Method:ELECTRON MICROSCOPY (2.85 Å)
Cite:Structure and infection dynamics of mycobacteriophage Bxb1
To Be Published
9CHP
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BU of 9chp by Molmil
Cryo-EM structure of the human ether-a-go-go related K+ channel (hERG) in 300 mM K+
Descriptor: Potassium voltage-gated channel subfamily H member 2
Authors:Lau, C.H.Y, Hunter, M.J, Vandenberg, J.I.
Deposit date:2024-07-01
Release date:2024-08-21
Last modified:2024-09-11
Method:ELECTRON MICROSCOPY (3.3 Å)
Cite:Potassium dependent structural changes in the selectivity filter of HERG potassium channels.
Nat Commun, 15, 2024
9BC3
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BU of 9bc3 by Molmil
Transglutaminase 2 - Alternate state
Descriptor: CALCIUM ION, HB-225 (gluten peptidomimetic TG2 inhibitor), Protein-glutamine gamma-glutamyltransferase 2
Authors:Mathews, I.I, Sewa, A.S, Khosla, C.
Deposit date:2024-04-07
Release date:2024-07-03
Last modified:2024-07-17
Method:X-RAY DIFFRACTION (2.52 Å)
Cite:Structural and mechanistic analysis of Ca 2+ -dependent regulation of transglutaminase 2 activity using a Ca 2+ -bound intermediate state.
Proc.Natl.Acad.Sci.USA, 121, 2024
9D94
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BU of 9d94 by Molmil
Mycobacteriophage Bxb1 portal and connector assembly - Composite map and model
Descriptor: Head-to-tail adaptor, Head-to-tail stopper, Major tail protein, ...
Authors:Freeman, K.G.
Deposit date:2024-08-20
Release date:2024-09-25
Method:ELECTRON MICROSCOPY (3 Å)
Cite:Structure and infection dynamics of mycobacteriophage Bxb1
To Be Published
9BLN
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BU of 9bln by Molmil
The structure of human Pdcd4 bound to the 40S-eIF4A-eIF3-eIF1 complex
Descriptor: 40S ribosomal protein S14, ACETIC ACID, Eukaryotic initiation factor 4A-I, ...
Authors:Brito Querido, J, Sokabe, M, Diaz-Lopez, I, Gordiyenko, Y, Zuber, P, Yifei, D, Albacete-Albacete, L, Ramakrishnan, V, S Fraser, C.
Deposit date:2024-04-30
Release date:2024-09-04
Last modified:2024-10-09
Method:ELECTRON MICROSCOPY (3.9 Å)
Cite:Human tumor suppressor protein Pdcd4 binds at the mRNA entry channel in the 40S small ribosomal subunit.
Nat Commun, 15, 2024

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PDB entries from 2024-10-09

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