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9F7F
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UP1 in complex with Z1491353358
分子名称: (3S)-1-(phenylsulfonyl)pyrrolidin-3-amine, Heterogeneous nuclear ribonucleoprotein A1, N-terminally processed
著者Dunnett, L, Prischi, F.
登録日2024-05-03
公開日2024-05-15
実験手法X-RAY DIFFRACTION (1.55 Å)
主引用文献Enhanced identification of small molecules binding to hnRNP A1 via in silico hotspot and cryptic pockets mapping coupled with X-Ray fragment screening
To Be Published
8ZHF
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BU of 8zhf by Molmil
SARS-CoV-2 spike trimer (6P) in complex with R1-26 Fab, head-to-head aggregate
分子名称: 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 R1-26 Fab, ...
著者Yan, Q, Gao, X, Liu, B, Hou, R, He, P, Li, Z, Chen, Q, Wang, J, He, J, Chen, L, Zhao, J, Xiong, X.
登録日2024-05-10
公開日2024-08-21
実験手法ELECTRON MICROSCOPY (5.26 Å)
主引用文献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
9EY4
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BU of 9ey4 by Molmil
The FK1 domain of FKBP51 in complex with (3S,11S)-12-((3,5-dichlorophenyl)sulfonyl)-5-oxo-11-vinyldecahydro-1H-6,10-epiminopyrrolo[1,2-a]azonine-3-carboxamide
分子名称: (1~{S},4~{S},7~{S},8~{S},9~{R})-13-[3,5-bis(chloranyl)phenyl]sulfonyl-8-ethenyl-2-oxidanylidene-3,13-diazatricyclo[7.3.1.0^{3,7}]tridecane-4-carboxamide, Peptidyl-prolyl cis-trans isomerase FKBP5
著者Meyners, C, Krajczy, P, Hausch, F.
登録日2024-04-09
公開日2024-06-12
最終更新日2024-08-28
実験手法X-RAY DIFFRACTION (1.16 Å)
主引用文献Structure-Based Design of Ultrapotent Tricyclic Ligands for FK506-Binding Proteins.
Chemistry, 30, 2024
9C54
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BU of 9c54 by Molmil
Crystal structure of human PTPN2 catalytic domain
分子名称: Tyrosine-protein phosphatase non-receptor type 2
著者Bester, S.M, Linwood, R, Wu, W.-I, Mou, T.-C.
登録日2024-06-05
公開日2024-09-04
最終更新日2024-09-25
実験手法X-RAY DIFFRACTION (2.05 Å)
主引用文献Enhancing the apo protein tyrosine phosphatase non-receptor type 2 crystal soaking strategy through inhibitor-accessible binding sites.
Acta Crystallogr.,Sect.F, 80, 2024
9B60
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BU of 9b60 by Molmil
GluA2 flip Q in complex with TARPgamma2 at pH8, consensus structure of TMD-TARPgamma2
分子名称: Isoform Flip of Glutamate receptor 2, Voltage-dependent calcium channel gamma-2 subunit
著者Nakagawa, T, Greger, I.H.
登録日2024-03-23
公開日2024-07-31
最終更新日2024-09-04
実験手法ELECTRON MICROSCOPY (2.57 Å)
主引用文献Proton-triggered rearrangement of the AMPA receptor N-terminal domains impacts receptor kinetics and synaptic localization.
Nat.Struct.Mol.Biol., 2024
8YMJ
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BU of 8ymj by Molmil
Cryo-EM structure of Hepatitis B virus surface antigen subviral particle with D2 symmetry
分子名称: Isoform S of Large envelope protein
著者Wang, T, Cao, L, Mu, A, Wang, Q, Rao, Z.H.
登録日2024-03-09
公開日2024-09-18
最終更新日2024-09-25
実験手法ELECTRON MICROSCOPY (6.6 Å)
主引用文献Inherent symmetry and flexibility in hepatitis B virus subviral particles.
Science, 385, 2024
9B61
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BU of 9b61 by Molmil
GluA2 flip Q in complex with TARPgamma2 at pH5, consensus structure of LBD-TMD-TARPgamma2
分子名称: Isoform Flip of Glutamate receptor 2, Voltage-dependent calcium channel gamma-2 subunit
著者Nakagawa, T, Greger, I.H.
登録日2024-03-23
公開日2024-07-31
最終更新日2024-09-04
実験手法ELECTRON MICROSCOPY (2.81 Å)
主引用文献Proton-triggered rearrangement of the AMPA receptor N-terminal domains impacts receptor kinetics and synaptic localization.
Nat.Struct.Mol.Biol., 2024
9C61
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BU of 9c61 by Molmil
Crystal structure of the human LRRK2 WDR domain in complex with CACHE1193-26
分子名称: (4R)-4-[4-(5-fluoro-1H-indol-3-yl)piperidine-1-carbonyl]piperidin-2-one, Non-specific serine/threonine protein kinase, UNKNOWN ATOM OR ION
著者Zeng, H, Dong, A, Kutera, M, Ilyassov, O, Seitova, A, Loppnau, P, Schapira, M, Arrowsmith, C.H, Edwards, A.M, Halabelian, L.
登録日2024-06-07
公開日2024-07-03
実験手法X-RAY DIFFRACTION (2.6 Å)
主引用文献Crystal structure of the human LRRK2 WDR domain in complex with CACHE1193-26
To be published
9FZ4
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BU of 9fz4 by Molmil
SARS CoV-2 nsp10 in complex with theExoN domain from nsp14
分子名称: GLYCEROL, Guanine-N7 methyltransferase nsp14, MAGNESIUM ION, ...
著者Fisher, S.Z.
登録日2024-07-04
公開日2024-07-17
実験手法X-RAY DIFFRACTION (2.44 Å)
主引用文献SARS CoV-2 nsp10 in complex with theExoN domain from nsp14
To Be Published
9EMC
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BU of 9emc by Molmil
RUVBL1/2 in complex with ATP
分子名称: ADENOSINE-5'-TRIPHOSPHATE, MAGNESIUM ION, RuvB-like 1, ...
著者Lopez-Perrote, A, Llorca, O, Garcia-Martin, C.
登録日2024-03-11
公開日2024-05-15
実験手法ELECTRON MICROSCOPY (3.26 Å)
主引用文献Mechanism of allosteric inhibition of RUVBL1-RUVBL2 by the small-molecule CB-6644
Cell Rep Phys Sci, 2024
9CWS
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BU of 9cws by Molmil
Bufavirus 1 at pH 2.6
分子名称: VP1
著者Gulkis, M.C, McKenna, R, Bennett, A.D.
登録日2024-07-30
公開日2024-08-21
最終更新日2024-09-18
実験手法ELECTRON MICROSCOPY (2.73 Å)
主引用文献Structural Characterization of Human Bufavirus 1: Receptor Binding and Endosomal pH-Induced Changes.
Viruses, 16, 2024
9CIA
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BU of 9cia by Molmil
T cell receptor complex
分子名称: CHOLESTEROL, T cell receptor delta constant, T cell receptor gamma constant 1, ...
著者Gully, B.S, Rossjohn, J.
登録日2024-07-03
公開日2024-07-31
実験手法ELECTRON MICROSCOPY (3.39 Å)
主引用文献T cell receptor complex
To Be Published
8Y6Q
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BU of 8y6q by Molmil
Structure of the Dark/Dronc complex
分子名称: Apaf-1 related killer DARK, Caspase Dronc
著者Tian, L, Li, Y, Shi, Y.
登録日2024-02-03
公開日2024-08-07
実験手法ELECTRON MICROSCOPY (7 Å)
主引用文献Dark and Dronc activation in Drosophila melanogaster.
Proc.Natl.Acad.Sci.USA, 121, 2024
9EY8
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BU of 9ey8 by Molmil
Crystal structure of human tyrosinase-related protein 1 (TYRP1) in complex with (s)-amino-L-tyrosine
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-[alpha-L-fucopyranose-(1-6)]2-acetamido-2-deoxy-beta-D-glucopyranose, ...
著者Ng, Y.M, Soler-Lopez, M.
登録日2024-04-09
公開日2024-05-01
最終更新日2024-07-03
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Interactions of Phenylalanine Derivatives with Human Tyrosinase: Lessons from Experimental and Theoretical tudies.
Chembiochem, 25, 2024
8ZYN
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BU of 8zyn by Molmil
Cryo-EM Structure of inhibitor-free hERG Channel
分子名称: Potassium voltage-gated channel subfamily H member 2
著者Miyashita, Y, Moriya, T, Kato, T, Kawasaki, M, Yasuda, Y, Adachi, N, Suzuki, K, Ogasawara, S, Saito, T, Senda, T, Murata, T.
登録日2024-06-18
公開日2024-09-18
実験手法ELECTRON MICROSCOPY (3.27 Å)
主引用文献Improved higher resolution Cryo-EM structures reveal the binding modes of hERG Channel Inhibitors
To Be Published
5X0Q
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BU of 5x0q by Molmil
OxyR2 E204G variant (Cl-bound) from Vibrio vulnificus
分子名称: CHLORIDE ION, CITRIC ACID, LysR family transcriptional regulator
著者Jo, I, Ha, N.-C.
登録日2017-01-23
公開日2017-03-15
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (1.55 Å)
主引用文献The hydrogen peroxide hypersensitivity of OxyR2 in Vibrio vulnificus depends on conformational constraints
J. Biol. Chem., 292, 2017
9F7H
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BU of 9f7h by Molmil
UP1 in complex with Z45617795
分子名称: Heterogeneous nuclear ribonucleoprotein A1, N-terminally processed, N-(2-phenylethyl)methanesulfonamide
著者Dunnett, L, Prischi, F.
登録日2024-05-03
公開日2024-05-15
実験手法X-RAY DIFFRACTION (1.43 Å)
主引用文献Enhanced identification of small molecules binding to hnRNP A1 via in silico hotspot and cryptic pockets mapping coupled with X-Ray fragment screening
To Be Published
9CHW
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BU of 9chw by Molmil
Crystal structure of human polymerase eta with incoming dAMPnPP nucleotide opposite threofuranosyl thymidine in DNA template
分子名称: 2'-deoxy-5'-O-[(R)-hydroxy{[(R)-hydroxy(phosphonooxy)phosphoryl]amino}phosphoryl]adenosine, DNA (5'-D(*AP*GP*CP*GP*TP*CP*AP*T)-3'), DNA (5'-D(*CP*AP*TP*(TFT)P*AP*TP*GP*AP*CP*GP*CP*T)-3'), ...
著者Tomar, R, Stone, M.P, Egli, M.
登録日2024-07-02
公開日2024-09-18
最終更新日2024-09-25
実験手法X-RAY DIFFRACTION (2.16 Å)
主引用文献DNA Replication across alpha-l-(3'-2')-Threofuranosyl Nucleotides Mediated by Human DNA Polymerase eta.
Biochemistry, 2024
8ZYQ
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BU of 8zyq by Molmil
Cryo-EM Structure of pimozide-bound hERG Channel
分子名称: 3-[1-[4,4-bis(4-fluorophenyl)butyl]piperidin-4-yl]-1~{H}-benzimidazol-2-one, Potassium voltage-gated channel subfamily H member 2
著者Miyashita, Y, Moriya, T, Kato, T, Kawasaki, M, Yasuda, Y, Adachi, N, Suzuki, K, Ogasawara, S, Saito, T, Senda, T, Murata, T.
登録日2024-06-18
公開日2024-09-18
実験手法ELECTRON MICROSCOPY (3.18 Å)
主引用文献Improved higher resolution Cryo-EM structures reveal the binding modes of hERG Channel Inhibitors
To Be Published
9F1S
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BU of 9f1s by Molmil
Structure of UP1 S4ES6E phosphomimetic mutant
分子名称: Heterogeneous nuclear ribonucleoprotein A1, N-terminally processed
著者Dunnett, L, Prischi, F.
登録日2024-04-20
公開日2024-05-01
実験手法X-RAY DIFFRACTION (1.5 Å)
主引用文献Structure of UP1 S4ES6E phosphomimetic mutant
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
9CEY
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BU of 9cey by Molmil
Spizellomyces punctatus Fanzor (SpuFz) State 5
分子名称: DNA (26-MER), DNA (36-MER), MAGNESIUM ION, ...
著者Xu, P, Saito, M, Zhang, F.
登録日2024-06-27
公開日2024-09-11
最終更新日2024-09-25
実験手法ELECTRON MICROSCOPY (3.22 Å)
主引用文献Structural insights into the diversity and DNA cleavage mechanism of Fanzor.
Cell, 2024
5X2G
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BU of 5x2g by Molmil
Crystal structure of Campylobacter jejuni Cas9 in complex with sgRNA and target DNA (AGAAACC PAM)
分子名称: 1,2-ETHANEDIOL, CRISPR-associated endonuclease Cas9, Non-target DNA strand, ...
著者Yamada, M, Watanabe, Y, Hirano, H, Nakane, T, Ishitani, R, Nishimasu, H, Nureki, O.
登録日2017-01-31
公開日2017-03-29
最終更新日2024-03-27
実験手法X-RAY DIFFRACTION (2.4 Å)
主引用文献Crystal Structure of the Minimal Cas9 from Campylobacter jejuni Reveals the Molecular Diversity in the CRISPR-Cas9 Systems
Mol. Cell, 65, 2017
9BA4
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BU of 9ba4 by Molmil
Full-length cross-linked Contactin 2 (CNTN2)
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, Contactin-2
著者Liu, J.L, Fan, S.F, Ren, G.R, Rudenko, G.R.
登録日2024-04-03
公開日2024-07-17
最終更新日2024-07-24
実験手法ELECTRON MICROSCOPY (3.54 Å)
主引用文献Molecular mechanism of contactin 2 homophilic interaction.
Structure, 2024
9F8G
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BU of 9f8g by Molmil
Photostatin (photoswitchable azo-combretastatin) Z-PST27 bound to tubulin-DARPin D1 complex
分子名称: 5-[(~{Z})-(3,5-diethyl-4-methoxy-phenyl)diazenyl]-2-methyl-phenol, CALCIUM ION, Designed Ankyrin Repeat Protein (DARPIN) D1, ...
著者Wranik, M, Steinmetz, M.O.
登録日2024-05-06
公開日2024-09-04
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献A photo-SAR study of photoswitchable azobenzene tubulin-inhibiting antimitotics identifying a general method for near-quantitative photocontrol.
Chem Sci, 15, 2024

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件を2024-09-25に公開中

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