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9D6M
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Nitrile hydratase BR157K mutant
分子名称: Cobalt-containing nitrile hydratase subunit alpha, Cobalt-containing nitrile hydratase subunit beta
著者Miller, C.G, Holz, R.C, Liu, D, Kaley, N.
登録日2024-08-15
公開日2024-08-28
実験手法X-RAY DIFFRACTION (1.56 Å)
主引用文献Role of second-sphere arginine residues in metal binding and metallocentre assembly in nitrile hydratases.
J Inorg Biochem, 256, 2024
9FCL
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CysG(N-16) in complex with SAM from Kitasatospora cystarginea
分子名称: 1,2-ETHANEDIOL, CALCIUM ION, DI(HYDROXYETHYL)ETHER, ...
著者Kuttenlochner, W, Beller, P, Kaysser, L, Groll, M.
登録日2024-05-15
公開日2024-08-21
最終更新日2024-09-18
実験手法X-RAY DIFFRACTION (1.75 Å)
主引用文献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
9BJY
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BU of 9bjy by Molmil
Crystal structure of RidA family protein PA5083 from Pseudomonas aeruginosa with TMAO bound
分子名称: RidA family protein, SULFATE ION, trimethylamine oxide
著者Zhou, D, Chen, L, Rose, J.P, Wang, B.C.
登録日2024-04-26
公開日2024-09-04
実験手法X-RAY DIFFRACTION (1.58 Å)
主引用文献Structure of the RidA protein PA5083 from Pseudomonas aeruginosa with TMAO bound
To Be Published
7AML
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BU of 7aml by Molmil
RET/GDNF/GFRa1 extracellular complex Cryo-EM structure
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, CALCIUM ION, GDNF family receptor alpha, ...
著者Adams, S.E, Earl, C.P, Purkiss, A.G, McDonald, N.Q.
登録日2020-10-09
公開日2021-01-13
最終更新日2021-07-14
実験手法ELECTRON MICROSCOPY (3.5 Å)
主引用文献A two-site flexible clamp mechanism for RET-GDNF-GFR alpha 1 assembly reveals both conformational adaptation and strict geometric spacing.
Structure, 29, 2021
9C0O
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BU of 9c0o by Molmil
Crystal structure of DmCfp1 PHD finger bound to H3K4me3
分子名称: CXXC-type zinc finger protein 1, DIMETHYL SULFOXIDE, Histone H3.3C, ...
著者Gregoire, S, Couture, J.F.
登録日2024-05-27
公開日2024-07-03
最終更新日2024-09-25
実験手法X-RAY DIFFRACTION (1.53 Å)
主引用文献Structural insights into an atypical histone binding mechanism by a PHD finger.
Structure, 32, 2024
9B5F
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BU of 9b5f by Molmil
Ubiquitin E1-Ub-E2 tetrahedral transthiolation intermediate mimic (doubly Ub-loaded) - cluster 1 map and model (Ub(A)/ATP/Mg)
分子名称: 4-aminobutanenitrile, ADENOSINE-5'-TRIPHOSPHATE, MAGNESIUM ION, ...
著者Kochanczyk, T, Lima, C.D.
登録日2024-03-22
公開日2024-06-05
最終更新日2024-09-18
実験手法ELECTRON MICROSCOPY (2.78 Å)
主引用文献Structural basis for transthiolation intermediates in the ubiquitin pathway.
Nature, 633, 2024
9J8E
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BU of 9j8e by Molmil
Structural insights into BirA from Haemophilus influenzae, a bifunctional protein as a biotin protein ligase and a transcriptional repressor
分子名称: BIOTINYL-5-AMP, Bifunctional ligase/repressor BirA
著者Lee, J.Y, Jeong, K.H, Son, S.B, Ko, J.H.
登録日2024-08-21
公開日2024-09-11
実験手法X-RAY DIFFRACTION (2.65 Å)
主引用文献Structural insights into BirA from Haemophilus influenzae, a bifunctional protein as a biotin protein ligase and a transcriptional repressor.
Biochem.Biophys.Res.Commun., 733, 2024
9C8S
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BU of 9c8s by Molmil
CryoEM structure of Cryptococcus neoformans H99 Acetyl-CoA Synthetase in complex with adenosine-5'-ethylphosphate
分子名称: 5'-O-[(S)-ethoxy(hydroxy)phosphoryl]adenosine, Acetyl-coenzyme A synthetase
著者Xu, Z, Schnicker, N.J, Jezeski, A.J, Krysan, D.J.
登録日2024-06-12
公開日2024-07-03
実験手法ELECTRON MICROSCOPY (2.37 Å)
主引用文献CryoEM structure of Cryptococcus neoformans H99 Acetyl-CoA Synthetase in complex with adenosine-5'-ethylphosphate
To Be Published
9BON
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BU of 9bon by Molmil
Crystal structure of glucosyltransferase (GTD) domain of TpeL
分子名称: TpeL
著者Gill, S, Sugiman-Marangos, S.N, Beilhartz, G.L, Mei, E, Taipale, M, Melnyk, R.A.
登録日2024-05-05
公開日2024-08-07
実験手法X-RAY DIFFRACTION (2.222 Å)
主引用文献A diphtheria toxin-like intracellular delivery platform that evades pre-existing antidrug antibodies.
Embo Mol Med, 2024
9CIW
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BU of 9ciw by Molmil
Penguinpox cGAMP PDE H72A mutant in complex with 2'3'-cGAMP
分子名称: Penguinpox cGAMP PDE, [(2~{R},3~{R},4~{R},5~{S})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl [(2~{R},3~{R},4~{S},5~{R})-2-(2-azanyl-6-oxidanylidene-1~{H}-purin-9-yl)-5-(hydroxymethyl)-4-oxidanyl-oxolan-3-yl] hydrogen phosphate
著者Hobbs, S.J, Nomburg, J, Doudna, J.A, Kranzusch, P.J.
登録日2024-07-05
公開日2024-09-04
最終更新日2024-09-11
実験手法X-RAY DIFFRACTION (2.4 Å)
主引用文献Animal and bacterial viruses share conserved mechanisms of immune evasion.
Cell, 2024
9EZG
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BU of 9ezg by Molmil
Crystal structure of human Casein Kinase II subunit alpha (CK2a1) in complex with 5-((4-((2-aminoethyl)(ethyl)amino)-3-(4H-1,2,4-triazol-4-yl)phenyl)amino)-7-(cyclopropylamino)pyrazolo[1,5-a]pyrimidine-3-carbonitrile
分子名称: 1,2-ETHANEDIOL, 5-[[4-[2-azanylethyl(ethyl)amino]-3-(1,2,4-triazol-4-yl)phenyl]amino]-7-(cyclopropylamino)pyrazolo[1,5-a]pyrimidine-3-carbonitrile, Casein kinase II subunit alpha, ...
著者Kraemer, A, Ong, H.W, Yang, X, Brown, J.W, Chang, E, Willson, T, Knapp, S, Structural Genomics Consortium (SGC)
登録日2024-04-12
公開日2024-07-31
最終更新日2024-08-07
実験手法X-RAY DIFFRACTION (2.18 Å)
主引用文献More than an Amide Bioisostere: Discovery of 1,2,4-Triazole-containing Pyrazolo[1,5- a ]pyrimidine Host CSNK2 Inhibitors for Combatting beta-Coronavirus Replication.
J.Med.Chem., 67, 2024
9J6I
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BU of 9j6i by Molmil
Crystal structure of the ABA receptor PYL1 in complex with DBSA compound
分子名称: 5-bromanyl-N2-[(4-bromophenyl)-bis(oxidanyl)-$l^4-sulfanyl]-N1,N1,N3,N3-tetrakis(oxidanyl)benzene-1,2,3-triamine, Abscisic acid receptor PYL1
著者Yan, J.
登録日2024-08-16
公開日2024-09-04
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Chemical control of plant water loss by stabilizing dimeric ABA receptor
To Be Published
9FCU
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BU of 9fcu by Molmil
CysG(N-16)-H121A mutant in complex with SAH from Kitasatospora cystarginea
分子名称: S-ADENOSYL-L-HOMOCYSTEINE, SAM-dependent methyltransferase
著者Kuttenlochner, W, Beller, P, Kaysser, L, Groll, M.
登録日2024-05-15
公開日2024-08-21
最終更新日2024-09-18
実験手法X-RAY DIFFRACTION (1.85 Å)
主引用文献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
9FEH
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BU of 9feh by Molmil
Crystal structure of SARS-CoV-2 nsp14 methyltransferase domain in complex with the STM957 inhibitor
分子名称: Transcription factor ETV6,Guanine-N7 methyltransferase nsp14, ZINC ION, ~{N}-[[(2~{R},3~{S},4~{R},5~{R})-5-[4-azanyl-5-(2-pyridin-3-ylethynyl)pyrrolo[2,3-d]pyrimidin-7-yl]-3,4-bis(oxidanyl)oxolan-2-yl]methyl]-3-cyano-~{N}-ethyl-4-methoxy-benzenesulfonamide
著者Zilecka, E, Klima, M, Boura, E.
登録日2024-05-20
公開日2024-08-28
最終更新日2024-09-04
実験手法X-RAY DIFFRACTION (1.99 Å)
主引用文献Structure of SARS-CoV-2 MTase nsp14 with the inhibitor STM957 reveals inhibition mechanism that is shared with a poxviral MTase VP39.
J Struct Biol X, 10, 2024
9EO4
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BU of 9eo4 by Molmil
Outward-open structure of human dopamine transporter bound to cocaine
分子名称: CHLORIDE ION, CHOLESTEROL, CHOLESTEROL HEMISUCCINATE, ...
著者Nielsen, J.C, Salomon, K, Kalenderoglou, I.E, Bargmeyer, S, Pape, T, Shahsavar, A, Loland, C.J.
登録日2024-03-14
公開日2024-07-03
最終更新日2024-08-28
実験手法ELECTRON MICROSCOPY (2.66 Å)
主引用文献Structure of the human dopamine transporter in complex with cocaine.
Nature, 632, 2024
9FS9
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BU of 9fs9 by Molmil
Self assembly domain of the surface layer protein of Viridibacillus arvi (aa 765-844)
分子名称: BROMIDE ION, S-layer
著者Grininger, C, Sagmeister, T, Pavkov-Keller, T.
登録日2024-06-20
公開日2024-08-28
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献SymProFold - Structural prediction of symmetrical biological assemblies
To Be Published
9C8R
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BU of 9c8r by Molmil
CryoEM structure of Apo Cryptococcus neoformans H99 Acetyl-CoA Synthetase
分子名称: Acetyl-coenzyme A synthetase
著者Xu, Z, Schnicker, N.J, Jezeski, A.J, Krysan, D.J.
登録日2024-06-12
公開日2024-07-03
実験手法ELECTRON MICROSCOPY (2.83 Å)
主引用文献CryoEM structure of Apo Cryptococcus neoformans H99 Acetyl-CoA Synthetase
To Be Published
9CGI
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BU of 9cgi by Molmil
Cryo-EM structure of the Nipah Virus polymerase (L) protein in complex with the tetrameric phosphoprotein (P)
分子名称: Phosphoprotein, RNA-directed RNA polymerase L
著者Liu, B, Yang, G, Wang, D.
登録日2024-06-29
公開日2024-09-18
実験手法ELECTRON MICROSCOPY (2.92 Å)
主引用文献Structure of the Nipah virus polymerase phosphoprotein complex.
Nat Commun, 2024
9FJD
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BU of 9fjd by Molmil
Expanded CVB1-VLP (Tween80)
分子名称: Capsid protein VP1, Capsid protein VP2, Capsid protein VP3
著者Plavec, Z, Butcher, S.J.
登録日2024-05-31
公開日2024-07-31
実験手法ELECTRON MICROSCOPY (2.15 Å)
主引用文献Comparison of structure and immunogenicity of CVB1-VLP and inactivated CVB1 vaccine candidates.
Res Sq, 2024
9BNR
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BU of 9bnr by Molmil
4-(2-isothiocyanatoethyl)benzenesulfonamide complexed with Macrophage Migration Inhibitory Factor
分子名称: Macrophage migration inhibitory factor, N-[2-(4-sulfamoylphenyl)ethyl]methanethioamide, SULFATE ION
著者Fellner, M, Rutledge, M.T, Putha, L, Kok, L.K, Gamble, A.B, Wilbanks, S.M, Vernall, A.J, Tyndall, J.D.A.
登録日2024-05-02
公開日2024-07-24
実験手法X-RAY DIFFRACTION (1.53 Å)
主引用文献Covalent isothiocyanate inhibitors of macrophage migration inhibitory factor as potential colorectal cancer treatments.
Chemmedchem, 2024
9B5B
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BU of 9b5b by Molmil
Ubiquitin E2-Ub-E3 HECT tetrahedral transthiolation intermediate mimic - state 7
分子名称: 4-aminobutanenitrile, E3 ubiquitin-protein ligase pub2, Ubiquitin, ...
著者Kochanczyk, T, Lima, C.D.
登録日2024-03-22
公開日2024-06-05
最終更新日2024-09-18
実験手法ELECTRON MICROSCOPY (3.31 Å)
主引用文献Structural basis for transthiolation intermediates in the ubiquitin pathway.
Nature, 633, 2024
4OY7
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BU of 4oy7 by Molmil
Structure of cellulose active LPMO CelS2 (ScLPMO10C) in complex with Copper.
分子名称: CALCIUM ION, COPPER (II) ION, Putative secreted cellulose binding protein
著者Forsberg, Z, Mackenzie, A.K, Sorlie, M, Rohr, A.K, Helland, R, Arvai, A.S, Vaaje-Kolstad, G, Eijsink, V.G.H.
登録日2014-02-11
公開日2014-05-28
最終更新日2023-12-27
実験手法X-RAY DIFFRACTION (1.5 Å)
主引用文献Structural and functional characterization of a conserved pair of bacterial cellulose-oxidizing lytic polysaccharide monooxygenases.
Proc.Natl.Acad.Sci.USA, 111, 2014
9F98
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BU of 9f98 by Molmil
Crystal structure of MUS81-EME1, apo form.
分子名称: Crossover junction endonuclease EME1, Crossover junction endonuclease MUS81
著者Collie, G.W.
登録日2024-05-07
公開日2024-07-03
最終更新日2024-07-31
実験手法X-RAY DIFFRACTION (2.15 Å)
主引用文献Fragment-Based Discovery of Novel MUS81 Inhibitors.
Acs Med.Chem.Lett., 15, 2024
9FX6
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BU of 9fx6 by Molmil
Crystal structure of Cryo2RT SARS-CoV-2 main protease at 100K
分子名称: 3C-like proteinase nsp5, DIMETHYL SULFOXIDE, MAGNESIUM ION, ...
著者Huang, C.Y, Aumonier, S, Mac Sweeney, A, Olieric, V, Wang, M.
登録日2024-07-01
公開日2024-07-31
最終更新日2024-08-14
実験手法X-RAY DIFFRACTION (2.227 Å)
主引用文献Cryo2RT: a high-throughput method for room-temperature macromolecular crystallography from cryo-cooled crystals.
Acta Crystallogr D Struct Biol, 80, 2024
9AZA
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BU of 9aza by Molmil
Crystal structure of LolTv4
分子名称: Aminotransferase, class V/Cysteine desulfurase, PYRIDOXAL-5'-PHOSPHATE
著者Gao, J, Hai, Y.
登録日2024-03-10
公開日2024-07-17
最終更新日2024-08-07
実験手法X-RAY DIFFRACTION (2.84 Å)
主引用文献Enzymatic Synthesis of Unprotected alpha , beta-Diamino Acids via Direct Asymmetric Mannich Reactions.
J.Am.Chem.Soc., 146, 2024

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件を2024-09-25に公開中

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