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5ZIT
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BU of 5zit by Molmil
Crystal structure of human Enterovirus D68 RdRp in complex with NADPH
分子名称: DI(HYDROXYETHYL)ETHER, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, RdRp
著者Wang, M.L, Li, L, Chen, Y.P, Jiang, H, Zhang, Y, Su, D.
登録日2018-03-17
公開日2019-04-17
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (3.196 Å)
主引用文献Structure of the enterovirus D68 RNA-dependent RNA polymerase in complex with NADPH implicates an inhibitor binding site in the RNA template tunnel.
J.Struct.Biol., 2020
7X77
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BU of 7x77 by Molmil
Ectodomain structure of per os infectivity factor 5
分子名称: Per os infectivity factor 5
著者Cao, S, Li, Z, Fu, Y.
登録日2022-03-09
公開日2022-06-22
最終更新日2024-10-09
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Structural Characterization of Per Os Infectivity Factor 5 (PIF5) Reveals the Essential Role of Intramolecular Interactions in Baculoviral Oral Infectivity.
J.Virol., 96, 2022
7WL4
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BU of 7wl4 by Molmil
Crystal Structure of the first bromodomain of human BRD4 in complex with the inhibitor SLP-50
分子名称: Bromodomain-containing protein 4, ~{N}-[2-ethyl-6-(4-methylpiperazin-1-yl)-3-oxidanylidene-2,7-diazatricyclo[6.3.1.0^{4,12}]dodeca-1(12),4,6,8,10-pentaen-9-yl]-2,4-bis(fluoranyl)benzenesulfonamide
著者Zhang, C, Wang, C, Li, W, Zhang, Y, Xu, Y, Sun, L.
登録日2022-01-12
公開日2022-08-10
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (1.82 Å)
主引用文献Design, synthesis, and anticancer evaluation of ammosamide B with pyrroloquinoline derivatives as novel BRD4 inhibitors.
Bioorg.Chem., 127, 2022
9JN8
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BU of 9jn8 by Molmil
Crystal structure of a thioredoxin-like ferredoxin of Rhodobacter capsulatus
分子名称: FE2/S2 (INORGANIC) CLUSTER, ORF378
著者Shen, Y, Liu, L.
登録日2024-09-22
公開日2025-02-19
最終更新日2025-04-02
実験手法X-RAY DIFFRACTION (2.12 Å)
主引用文献Crystal Structure of a Thioredoxin-like Ferredoxin Encoded Within a Cobalamin Biosynthetic Operon of Rhodobacter capsulatus.
Protein J., 44, 2025
3QNO
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BU of 3qno by Molmil
RB69 DNA Polymerase (Y567A) Ternary Complex with dATP Opposite 3tCo
分子名称: ADENOSINE-5'-TRIPHOSPHATE, CALCIUM ION, DNA Polymerase, ...
著者Xia, S, Wang, M, Wang, J, Konigsberg, W.H.
登録日2011-02-08
公開日2012-03-14
最終更新日2024-02-21
実験手法X-RAY DIFFRACTION (1.88 Å)
主引用文献Using a Fluorescent Cytosine Analogue tC(o) To Probe the Effect of the Y567 to Ala Substitution on the Preinsertion Steps of dNMP Incorporation by RB69 DNA Polymerase.
Biochemistry, 51, 2012
8WPJ
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BU of 8wpj by Molmil
Anabaena McyI with prebound NAD and soaked NAD
分子名称: McyI, NICOTINAMIDE-ADENINE-DINUCLEOTIDE
著者Wang, X, Yin, Y, Duan, Y, Liu, L.
登録日2023-10-10
公開日2024-10-16
最終更新日2025-04-30
実験手法X-RAY DIFFRACTION (2.8 Å)
主引用文献Structural insights into the catalytic mechanism of the microcystin tailoring enzyme McyI.
Commun Biol, 8, 2025
8WPH
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BU of 8wph by Molmil
Anabaena McyI with prebound NAD
分子名称: McyI-NAD, NICOTINAMIDE-ADENINE-DINUCLEOTIDE
著者Wang, X, Yin, Y, Duan, Y, Liu, L.
登録日2023-10-10
公開日2024-10-16
最終更新日2025-04-30
実験手法X-RAY DIFFRACTION (2.8 Å)
主引用文献Structural insights into the catalytic mechanism of the microcystin tailoring enzyme McyI.
Commun Biol, 8, 2025
8WPI
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BU of 8wpi by Molmil
Anabaena McyI with prebound NAD and soaked NADP
分子名称: McyI, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, NICOTINAMIDE-ADENINE-DINUCLEOTIDE
著者Wang, X, Yin, Y, Duan, Y, Liu, L.
登録日2023-10-10
公開日2024-10-16
最終更新日2025-04-30
実験手法X-RAY DIFFRACTION (2.201 Å)
主引用文献Structural insights into the catalytic mechanism of the microcystin tailoring enzyme McyI.
Commun Biol, 8, 2025
8WPQ
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BU of 8wpq by Molmil
Anabaena McyI R166M with prebound NAD and citrate
分子名称: CITRATE ANION, McyI, NICOTINAMIDE-ADENINE-DINUCLEOTIDE
著者Wang, X, Yin, Y, Duan, Y, Liu, L.
登録日2023-10-10
公開日2024-10-16
最終更新日2025-04-30
実験手法X-RAY DIFFRACTION (2.6 Å)
主引用文献Structural insights into the catalytic mechanism of the microcystin tailoring enzyme McyI.
Commun Biol, 8, 2025
8WPS
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BU of 8wps by Molmil
Anabaena McyI R166M with prebound NAD and malate
分子名称: (2S)-2-hydroxybutanedioic acid, McyI, NICOTINAMIDE-ADENINE-DINUCLEOTIDE
著者Wang, X, Yin, Y, Duan, Y, Liu, L.
登録日2023-10-10
公開日2024-10-16
最終更新日2025-04-30
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Structural insights into the catalytic mechanism of the microcystin tailoring enzyme McyI.
Commun Biol, 8, 2025
8WPO
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BU of 8wpo by Molmil
Anabaena McyI R166A with prebound NAD and citrate
分子名称: CITRATE ANION, McyI, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, ...
著者Wang, X, Yin, Y, Duan, Y, Liu, L.
登録日2023-10-10
公開日2024-10-16
最終更新日2025-04-30
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Structural insights into the catalytic mechanism of the microcystin tailoring enzyme McyI.
Commun Biol, 8, 2025
8WPR
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BU of 8wpr by Molmil
Anabaena McyI R166A with prebound NAD and malate
分子名称: (2S)-2-hydroxybutanedioic acid, GLYCEROL, McyI, ...
著者Wang, X, Yin, Y, Duan, Y, Liu, L.
登録日2023-10-10
公開日2024-10-16
最終更新日2025-04-30
実験手法X-RAY DIFFRACTION (1.7 Å)
主引用文献Structural insights into the catalytic mechanism of the microcystin tailoring enzyme McyI.
Commun Biol, 8, 2025
3TSY
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BU of 3tsy by Molmil
4-Coumaroyl-CoA Ligase::Stilbene Synthase fusion protein
分子名称: Fusion Protein 4-coumarate--CoA ligase 1, Resveratrol synthase
著者Yi, H, Jez, J.M.
登録日2011-09-13
公開日2011-12-14
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (3.1 Å)
主引用文献Structural and Kinetic Analysis of the Unnatural Fusion Protein 4-Coumaroyl-CoA Ligase::Stilbene Synthase.
J.Am.Chem.Soc., 133, 2011
6IK4
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BU of 6ik4 by Molmil
A Novel M23 Metalloprotease Pseudoalterin from Deep-sea
分子名称: Elastinolytic metalloprotease, GLYCEROL, ZINC ION
著者Zhao, H.L, Tang, B.L, Yang, J, Chen, X.L, Zhang, Y.Z.
登録日2018-10-14
公開日2019-10-16
最終更新日2024-10-09
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献A predator-prey interaction between a marine Pseudoalteromonas sp. and Gram-positive bacteria.
Nat Commun, 11, 2020
7YZ2
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BU of 7yz2 by Molmil
Molecular snapshots of drug release from tubulin: 10 milliseconds after photoactivation.
分子名称: Designed Ankyrin Repeat Protein (DARPIN) D1, GUANOSINE-5'-DIPHOSPHATE, GUANOSINE-5'-TRIPHOSPHATE, ...
著者Wranik, M, Weinert, T, Standfuss, J.
登録日2022-02-18
公開日2023-02-22
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Watching the release of a photopharmacological drug from tubulin using time-resolved serial crystallography.
Nat Commun, 14, 2023
7YZ5
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BU of 7yz5 by Molmil
Molecular snapshots of drug release from tubulin: 100 milliseconds (steady state)
分子名称: CALCIUM ION, Designed Ankyrin Repeat Protein (DARPIN) D1, GUANOSINE-5'-DIPHOSPHATE, ...
著者Wranik, M, Weinert, T, Standfuss, J.
登録日2022-02-18
公開日2023-02-22
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (2.11 Å)
主引用文献Watching the release of a photopharmacological drug from tubulin using time-resolved serial crystallography.
Nat Commun, 14, 2023
3HYF
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BU of 3hyf by Molmil
Crystal structure of HIV-1 RNase H p15 with engineered E. coli loop and active site inhibitor
分子名称: 2-(3,4-dichlorobenzyl)-5,6-dihydroxypyrimidine-4-carboxylic acid, ACETATE ION, GLYCEROL, ...
著者Lansdon, E.B, Kirschberg, T.A.
登録日2009-06-22
公開日2009-10-20
最終更新日2024-03-13
実験手法X-RAY DIFFRACTION (1.7 Å)
主引用文献RNase H active site inhibitors of human immunodeficiency virus type 1 reverse transcriptase: design, biochemical activity, and structural information.
J.Med.Chem., 52, 2009
6RYO
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BU of 6ryo by Molmil
Bacterial membrane enzyme structure by the in meso method at 1.9 A resolution
分子名称: (2R)-2,3-dihydroxypropyl (9Z)-octadec-9-enoate, 2-(2-(2-(2-(2-(2-ETHOXYETHOXY)ETHOXY)ETHOXY)ETHOXY)ETHOXY)ETHANOL, GLYCEROL, ...
著者Huang, C.Y, Olatunji, S, Bailey, J, Yu, X, Olieric, V, Wang, M, Caffrey, M.
登録日2019-06-11
公開日2020-01-15
最終更新日2024-11-13
実験手法X-RAY DIFFRACTION (1.924 Å)
主引用文献Structures of lipoprotein signal peptidase II from Staphylococcus aureus complexed with antibiotics globomycin and myxovirescin.
Nat Commun, 11, 2020
7DEO
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BU of 7deo by Molmil
Crystal structure of SARS-CoV-2 RBD in complex with a neutralizing antibody scFv
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, CALCIUM ION, Spike protein S1, ...
著者Fu, D, Zhang, G, Li, X, Rao, Z, Guo, Y.
登録日2020-11-04
公開日2021-03-31
最終更新日2024-11-13
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Structural basis for SARS-CoV-2 neutralizing antibodies with novel binding epitopes.
Plos Biol., 19, 2021
7DET
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BU of 7det by Molmil
Crystal structure of SARS-CoV-2 RBD in complex with a neutralizing antibody scFv
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, Spike protein S1, antibody scFv
著者Wang, Y, Zhang, G, Li, X, Rao, Z, Guo, Y.
登録日2020-11-05
公開日2021-03-31
最終更新日2024-11-20
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Structural basis for SARS-CoV-2 neutralizing antibodies with novel binding epitopes.
Plos Biol., 19, 2021
7XRJ
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BU of 7xrj by Molmil
crystal structure of N-acetyltransferase DgcN-25328
分子名称: Putative NAD-dependent epimerase/dehydratase family protein, SULFATE ION
著者Zhang, Y.Z, Yu, Y, Cao, H.Y, Chen, X.L, Wang, P.
登録日2022-05-10
公開日2023-02-01
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Novel D-glutamate catabolic pathway in marine Proteobacteria and halophilic archaea.
Isme J, 17, 2023
6K2O
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BU of 6k2o by Molmil
Structural basis of glycan recognition in globally predominant human P[8] rotavirus
分子名称: Outer capsid protein VP4, SODIUM ION, alpha-L-fucopyranose-(1-2)-beta-D-galactopyranose-(1-3)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-3)-beta-D-galactopyranose
著者Duan, Z, Sun, X.
登録日2019-05-15
公開日2019-10-09
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (2.296 Å)
主引用文献Structural Basis of Glycan Recognition in Globally Predominant Human P[8] Rotavirus.
Virol Sin, 35, 2020
7DEU
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BU of 7deu by Molmil
Crystal structure of SARS-CoV-2 RBD in complex with a neutralizing antibody scFv
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, Spike protein S1, antibody scFv
著者Zhang, Z, Zhang, G, Li, X, Rao, Z, Guo, Y.
登録日2020-11-05
公開日2021-03-31
最終更新日2024-11-13
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Structural basis for SARS-CoV-2 neutralizing antibodies with novel binding epitopes.
Plos Biol., 19, 2021
7YZ0
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BU of 7yz0 by Molmil
Molecular snapshots of drug release from tubulin: 100 microseconds after photoactivation.
分子名称: Azo-Combretastatin A4 (trans), CALCIUM ION, Designed Ankyrin Repeat Protein (DARPIN) D1, ...
著者Wranik, M, Weinert, T, Standfuss, J.
登録日2022-02-18
公開日2023-02-22
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Watching the release of a photopharmacological drug from tubulin using time-resolved serial crystallography.
Nat Commun, 14, 2023
7YYZ
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BU of 7yyz by Molmil
Molecular snapshots of drug release from tubulin: 10 microseconds after photoactivation.
分子名称: Azo-Combretastatin A4 (trans), CALCIUM ION, Designed Ankyrin Repeat Protein (DARPIN) D1, ...
著者Wranik, M, Weinert, T, Standfuss, J.
登録日2022-02-18
公開日2023-02-22
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Watching the release of a photopharmacological drug from tubulin using time-resolved serial crystallography.
Nat Commun, 14, 2023

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