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7KJ7
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BU of 7kj7 by Molmil
Plasmodium falciparum protein Pf12p
Descriptor: Surface protein P12p
Authors:Dietrich, M.H, Tham, W.H.
Deposit date:2020-10-26
Release date:2021-02-03
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (2.8 Å)
Cite:Nanobody generation and structural characterization of Plasmodium falciparum 6-cysteine protein Pf12p.
Biochem.J., 478, 2021
5AWH
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BU of 5awh by Molmil
Rhodobacter sphaeroides Argonaute in complex with guide RNA/target DNA heteroduplex
Descriptor: DNA (5'-D(*CP*GP*AP*GP*GP*TP*AP*GP*TP*AP*GP*GP*TP*TP*GP*TP*AP*A)-3'), MAGNESIUM ION, RNA (5'-D(P*UP*UP*AP*CP*AP*AP*CP*CP*UP*AP*CP*UP*AP*CP*CP*UP*CP*G)-3'), ...
Authors:Miyoshi, T, Ito, K, Murakami, R, Uchiumi, T.
Deposit date:2015-07-03
Release date:2016-07-06
Last modified:2024-03-20
Method:X-RAY DIFFRACTION (2 Å)
Cite:Structural basis for the recognition of guide RNA and target DNA heteroduplex by Argonaute.
Nat Commun, 7, 2016
5O9A
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BU of 5o9a by Molmil
Crystal structure of the GluA2 ligand-binding domain (S1S2J-L504Y-N775S) in complex with glutamate and BPAM121 at 1.78 A resolution
Descriptor: 1,2-ETHANEDIOL, 7-chloro-4-(2-fluoroethyl)-2,3-dihydro-1,2,4-benzothiadiazine 1,1-dioxide, CHLORIDE ION, ...
Authors:Laulumaa, S, Rovinskaja, K, Frydenvang, K.A, Kastrup, J.S.
Deposit date:2017-06-16
Release date:2018-01-03
Last modified:2024-10-16
Method:X-RAY DIFFRACTION (1.78 Å)
Cite:7-Phenoxy-Substituted 3,4-Dihydro-2H-1,2,4-benzothiadiazine 1,1-Dioxides as Positive Allosteric Modulators of alpha-Amino-3-hydroxy-5-methyl-4-isoxazolepropionic Acid (AMPA) Receptors with Nanomolar Potency.
J. Med. Chem., 61, 2018
7KOE
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BU of 7koe by Molmil
Electron bifurcating flavoprotein Fix/EtfABCX
Descriptor: Electron transfer flavoprotein, alpha subunit, beta subunit, ...
Authors:Feng, X, Li, H.
Deposit date:2020-11-08
Release date:2021-01-20
Last modified:2024-03-06
Method:ELECTRON MICROSCOPY (2.9 Å)
Cite:Cryoelectron microscopy structure and mechanism of the membrane-associated electron-bifurcating flavoprotein Fix/EtfABCX.
Proc.Natl.Acad.Sci.USA, 118, 2021
5OBR
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BU of 5obr by Molmil
Aurora A kinase in complex with 2-(3-chloro-5-fluorophenyl)quinoline-4-carboxylic acid and JNJ-7706621
Descriptor: 2-(3-chloranyl-5-fluoranyl-phenyl)quinoline-4-carboxylic acid, 4-({5-amino-1-[(2,6-difluorophenyl)carbonyl]-1H-1,2,4-triazol-3-yl}amino)benzenesulfonamide, Aurora kinase A, ...
Authors:Rossmann, M, Janecek, M, Hyvonen, M.
Deposit date:2017-06-29
Release date:2017-08-09
Last modified:2024-05-08
Method:X-RAY DIFFRACTION (2.62 Å)
Cite:Computationally-guided optimization of small-molecule inhibitors of the Aurora A kinase-TPX2 protein-protein interaction.
Chem. Commun. (Camb.), 53, 2017
5UZB
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BU of 5uzb by Molmil
Cryo-EM structure of the MAL TIR domain filament
Descriptor: Toll/interleukin-1 receptor domain-containing adapter protein
Authors:Ve, T, Vajjhala, P.R, Hedger, A, Croll, T, DiMaio, F, Horsefield, S, Yu, X, Lavrencic, P, Hassan, Z, Morgan, G.P, Mansell, A, Mobli, M, O'Carrol, A, Chauvin, B, Gambin, Y, Sierecki, E, Landsberg, M.J, Stacey, K.J, Egelman, E.H, Kobe, B.
Deposit date:2017-02-25
Release date:2017-07-26
Last modified:2020-01-15
Method:ELECTRON MICROSCOPY (7 Å)
Cite:Structural basis of TIR-domain-assembly formation in MAL- and MyD88-dependent TLR4 signaling.
Nat. Struct. Mol. Biol., 24, 2017
5OCS
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BU of 5ocs by Molmil
Ene-reductase (ER/OYE) from Ralstonia (Cupriavidus) metallidurans
Descriptor: ACETATE ION, CITRIC ACID, FLAVIN MONONUCLEOTIDE, ...
Authors:Opperman, D.J.
Deposit date:2017-07-03
Release date:2017-09-06
Last modified:2024-01-17
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Structural investigation into the C-terminal extension of the ene-reductase from Ralstonia (Cupriavidus) metallidurans.
Proteins, 85, 2017
5OEW
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BU of 5oew by Molmil
Crystal structure of the GluA2 ligand-binding domain (S1S2J) in complex with glutamate and positive allosteric modulator BPAM538
Descriptor: 4-cyclopropyl-7-(3-methoxyphenoxy)-2,3-dihydro-1$l^{6},2,4-benzothiadiazine 1,1-dioxide, ACETATE ION, GLUTAMIC ACID, ...
Authors:Larsen, A.P, Frydenvang, K.A, Kastrup, J.S.
Deposit date:2017-07-10
Release date:2018-01-03
Last modified:2024-01-17
Method:X-RAY DIFFRACTION (2 Å)
Cite:7-Phenoxy-Substituted 3,4-Dihydro-2H-1,2,4-benzothiadiazine 1,1-Dioxides as Positive Allosteric Modulators of alpha-Amino-3-hydroxy-5-methyl-4-isoxazolepropionic Acid (AMPA) Receptors with Nanomolar Potency.
J. Med. Chem., 61, 2018
5A8B
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BU of 5a8b by Molmil
Structure of a parallel dimer of the aureochrome 1a LOV domain from Phaeodactylum tricornutum
Descriptor: CHLORIDE ION, FLAVIN MONONUCLEOTIDE, GLYCEROL, ...
Authors:Banerjee, A, Herman, E, Kottke, T, Essen, L.O.
Deposit date:2015-07-14
Release date:2016-02-10
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (2.791 Å)
Cite:Structure of a Native-Like Aureochrome 1A Lov Domain Dimer from Phaeodactylum Tricornutum.
Structure, 24, 2016
5A8F
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BU of 5a8f by Molmil
Structure and genome release mechanism of human cardiovirus Saffold virus-3
Descriptor: GENOME POLYPHUMAN SAFFOLD VIRUS-3 VP3 PROTEIN, HUMAN SAFFOLD VIRUS-3 VP1, HUMAN SAFFOLD VIRUS-3 VP2
Authors:Mullapudi, E, Novacek, J, Palkova, L, Kulich, P, Lindberg, M, vanKuppeveld, F.J.M, Plevka, P.
Deposit date:2015-07-15
Release date:2016-06-08
Last modified:2019-10-30
Method:ELECTRON MICROSCOPY (10.6 Å)
Cite:Structure and Genome Release Mechanism of Human Cardiovirus Saffold Virus-3.
J.Virol., 90, 2016
7UN6
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BU of 7un6 by Molmil
Complex of UBE2O with NAP1L1
Descriptor: (E3-independent) E2 ubiquitin-conjugating enzyme, Nucleosome assembly protein 1-like 1
Authors:Yip, M.C.J, Sedor, S.F, Shao, S.
Deposit date:2022-04-09
Release date:2022-08-03
Last modified:2024-02-14
Method:ELECTRON MICROSCOPY (3.3 Å)
Cite:Mechanism of client selection by the protein quality-control factor UBE2O.
Nat.Struct.Mol.Biol., 29, 2022
5OID
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BU of 5oid by Molmil
Complex Trichoplax STIL-NTD:human CEP85 coiled coil domain 4
Descriptor: Centrosomal protein of 85 kDa, Putative uncharacterized protein
Authors:van Breugel, M.
Deposit date:2017-07-18
Release date:2018-04-18
Last modified:2018-05-09
Method:X-RAY DIFFRACTION (4.6 Å)
Cite:Direct binding of CEP85 to STIL ensures robust PLK4 activation and efficient centriole assembly.
Nat Commun, 9, 2018
5OKM
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BU of 5okm by Molmil
Crystal structure of human SHIP2 Phosphatase-C2
Descriptor: 1,2-ETHANEDIOL, 2-[3-(2-HYDROXY-1,1-DIHYDROXYMETHYL-ETHYLAMINO)-PROPYLAMINO]-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, NITRATE ION, ...
Authors:Le Coq, J, Lietha, D.
Deposit date:2017-07-25
Release date:2017-08-23
Last modified:2024-01-17
Method:X-RAY DIFFRACTION (1.96 Å)
Cite:Structural basis for interdomain communication in SHIP2 providing high phosphatase activity.
Elife, 6, 2017
5UQM
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BU of 5uqm by Molmil
Clostridium difficile Toxin B (TcdB) glucosyltransferase domain in complex with U2F
Descriptor: MANGANESE (II) ION, SULFATE ION, Toxin B, ...
Authors:Alvin, J.W, Lacy, D.B.
Deposit date:2017-02-08
Release date:2017-05-10
Last modified:2023-10-04
Method:X-RAY DIFFRACTION (2.03 Å)
Cite:Clostridium difficile toxin glucosyltransferase domains in complex with a non-hydrolyzable UDP-glucose analogue.
J. Struct. Biol., 198, 2017
4ZZI
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BU of 4zzi by Molmil
SIRT1/Activator/Inhibitor Complex
Descriptor: (3S)-1,3-dimethyl-N-[3-(1,3-oxazol-5-yl)phenyl]-6-[3-(trifluoromethyl)phenyl]-2,3-dihydropyrido[2,3-b]pyrazine-4(1H)-carboxamide, 4-(4-{2-[(methylsulfonyl)amino]ethyl}piperidin-1-yl)thieno[3,2-d]pyrimidine-6-carboxamide, NAD-dependent protein deacetylase sirtuin-1, ...
Authors:Dai, H.
Deposit date:2015-05-22
Release date:2015-07-15
Last modified:2023-09-27
Method:X-RAY DIFFRACTION (2.7346 Å)
Cite:Crystallographic structure of a small molecule SIRT1 activator-enzyme complex.
Nat Commun, 6, 2015
7FVS
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BU of 7fvs by Molmil
Crystal Structure of S. aureus gyrase in complex with 4-[[1-[(1-chloro-6,7-dihydro-5H-cyclopenta[c]pyridin-6-yl)methyl]azetidin-3-yl]methylamino]-6-fluorochromen-2-one
Descriptor: 4-{[(1-{[(6R)-1-chloro-6,7-dihydro-5H-cyclopenta[c]pyridin-6-yl]methyl}azetidin-3-yl)methyl]amino}-6-fluoro-2H-1-benzopyran-2-one, ACETATE ION, CHLORIDE ION, ...
Authors:Xu, B, Benz, J, Cumming, J.G, Kreis, L, Rudolph, M.G.
Deposit date:2023-04-18
Release date:2023-06-28
Last modified:2023-08-16
Method:X-RAY DIFFRACTION (2.16 Å)
Cite:Discovery of a Series of Indane-Containing NBTIs with Activity against Multidrug-Resistant Gram-Negative Pathogens.
Acs Med.Chem.Lett., 14, 2023
5OLM
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BU of 5olm by Molmil
TRIM21
Descriptor: E3 ubiquitin-protein ligase TRIM21, ZINC ION
Authors:James, L.C.
Deposit date:2017-07-28
Release date:2018-04-25
Last modified:2024-05-08
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:Intracellular antibody signalling is regulated by phosphorylation of the Fc receptor TRIM21.
Elife, 7, 2018
8AFV
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BU of 8afv by Molmil
DaArgC3 - Engineered Formyl Phosphate Reductase with 3 substitutions (S178V, G182V, L233I)
Descriptor: N-acetyl-gamma-glutamyl-phosphate reductase, SODIUM ION
Authors:Pfister, P, Nattermann, M, Zarzycki, J, Erb, T.J.
Deposit date:2022-07-18
Release date:2023-04-05
Last modified:2024-10-23
Method:X-RAY DIFFRACTION (2.19 Å)
Cite:Engineering a new-to-nature cascade for phosphate-dependent formate to formaldehyde conversion in vitro and in vivo.
Nat Commun, 14, 2023
7FVT
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BU of 7fvt by Molmil
Crystal Structure of S. aureus gyrase in complex with 6-[5-[2-[(4-chloro-2,3-dihydro-1H-inden-2-yl)methylamino]ethyl]-2-oxo-1,3-oxazolidin-3-yl]-4H-pyrido[3,2-b][1,4]oxazin-3-one
Descriptor: 6-{(5R)-5-[2-({[(2R)-4-chloro-2,3-dihydro-1H-inden-2-yl]methyl}amino)ethyl]-2-oxo-1,3-oxazolidin-3-yl}-2H-pyrido[3,2-b][1,4]oxazin-3(4H)-one, CHLORIDE ION, DNA (5'-D(*AP*GP*CP*CP*GP*TP*AP*GP*GP*GP*CP*CP*CP*TP*AP*CP*GP*GP*CP*T)-3'), ...
Authors:Xu, B, Benz, J, Cumming, J.G, Rudolph, M.G.
Deposit date:2023-04-18
Release date:2023-06-28
Last modified:2023-08-16
Method:X-RAY DIFFRACTION (2.081 Å)
Cite:Discovery of a Series of Indane-Containing NBTIs with Activity against Multidrug-Resistant Gram-Negative Pathogens.
Acs Med.Chem.Lett., 14, 2023
7UN3
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BU of 7un3 by Molmil
Complex of UBE2O with NAP1L1 and ubiquitylated uL2
Descriptor: Nucleosome assembly protein 1-like 1, Ubiquitin,60S ribosomal protein L8,(E3-independent) E2 ubiquitin-conjugating enzyme fusion
Authors:Yip, M.C.J, Sedor, S.F, Shao, S.
Deposit date:2022-04-08
Release date:2022-08-03
Last modified:2024-02-14
Method:ELECTRON MICROSCOPY (3.5 Å)
Cite:Mechanism of client selection by the protein quality-control factor UBE2O.
Nat.Struct.Mol.Biol., 29, 2022
8AFU
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BU of 8afu by Molmil
DaArgC - N-acetyl-gamma-glutamyl-phosphate Reductase of Denitrovibrio acetiphilus
Descriptor: N-acetyl-gamma-glutamyl-phosphate reductase, SODIUM ION
Authors:Pfister, P, Nattermann, M, Zarzycki, J, Erb, T.J.
Deposit date:2022-07-18
Release date:2023-04-05
Last modified:2024-10-23
Method:X-RAY DIFFRACTION (1.99 Å)
Cite:Engineering a new-to-nature cascade for phosphate-dependent formate to formaldehyde conversion in vitro and in vivo.
Nat Commun, 14, 2023
8AVE
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BU of 8ave by Molmil
Human leptin in complex with the human LEP-R ectodomain fused to a C-terminal trimeric isoleucine GCN4 zipper (2:2 model)
Descriptor: Leptin, Leptin receptor
Authors:Verstraete, K, Savvides, S.N, Verschueren, K.G, Tsirigotaki, A.
Deposit date:2022-08-26
Release date:2023-04-05
Last modified:2024-10-23
Method:ELECTRON MICROSCOPY (5.62 Å)
Cite:Mechanism of receptor assembly via the pleiotropic adipokine Leptin.
Nat.Struct.Mol.Biol., 30, 2023
5VYZ
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BU of 5vyz by Molmil
Crystal structure of Lactococcus lactis pyruvate carboxylase in complex with cyclic-di-AMP
Descriptor: (2R,3R,3aS,5R,7aR,9R,10R,10aS,12R,14aR)-2,9-bis(6-amino-9H-purin-9-yl)octahydro-2H,7H-difuro[3,2-d:3',2'-j][1,3,7,9,2,8 ]tetraoxadiphosphacyclododecine-3,5,10,12-tetrol 5,12-dioxide, ADENOSINE-5'-DIPHOSPHATE, MAGNESIUM ION, ...
Authors:Choi, P.H, Tong, L.
Deposit date:2017-05-26
Release date:2017-08-16
Last modified:2024-03-13
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Structural and functional studies of pyruvate carboxylase regulation by cyclic di-AMP in lactic acid bacteria.
Proc. Natl. Acad. Sci. U.S.A., 114, 2017
8AG8
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BU of 8ag8 by Molmil
Structure of the Fluorescence Recovery-like protein FRPL from Pseudomonas borbori
Descriptor: 2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACID, Fluorescence Recovery-like protein
Authors:Weiland, P, Bange, G.
Deposit date:2022-07-19
Release date:2023-04-05
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Fortuitously compatible protein surfaces primed allosteric control in cyanobacterial photoprotection.
Nat Ecol Evol, 7, 2023
5O85
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BU of 5o85 by Molmil
p34-p44 complex
Descriptor: General transcription factor IIH subunit 2, General transcription factor IIH subunit 3, ZINC ION
Authors:Radu, L, Poterszman, A.
Deposit date:2017-06-12
Release date:2017-10-18
Last modified:2024-01-17
Method:X-RAY DIFFRACTION (3.4 Å)
Cite:The intricate network between the p34 and p44 subunits is central to the activity of the transcription/DNA repair factor TFIIH.
Nucleic Acids Res., 45, 2017

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