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8OH0
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BU of 8oh0 by Molmil
PanDDA analysis group deposition -- CdaA in complex with fragment F2X-Entry D08
分子名称: 1-(2-ethylsulfonylethyl)-1,3,3-trimethyl-urea, Cyclic di-AMP synthase CdaA, MAGNESIUM ION
著者Garbers, T.B, Neumann, P, Wollenhaupt, J, Weiss, M.S, Ficner, R.
登録日2023-03-20
公開日2024-03-27
実験手法X-RAY DIFFRACTION (1.27 Å)
主引用文献PanDDA analysis group deposition -- CdaA in complex with fragment F2X-Entry D08
To Be Published
8OGU
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BU of 8ogu by Molmil
PanDDA analysis group deposition -- CdaA in complex with fragment F2X-Entry C07
分子名称: 3,4-dihydro-1~{H}-quinolin-2-one, Cyclic di-AMP synthase CdaA, MAGNESIUM ION
著者Garbers, T.B, Neumann, P, Wollenhaupt, J, Weiss, M.S, Ficner, R.
登録日2023-03-20
公開日2024-03-27
実験手法X-RAY DIFFRACTION (1.41 Å)
主引用文献PanDDA analysis group deposition -- CdaA in complex with fragment F2X-Entry C07
To Be Published
8OGM
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BU of 8ogm by Molmil
Crystal structure of CdaA from Bacillus subtilis
分子名称: Cyclic di-AMP synthase CdaA
著者Garbers, T.B, Neumann, P, Weiss, M.S, Wollenhaupt, J, Ficner, R.
登録日2023-03-20
公開日2024-03-27
実験手法X-RAY DIFFRACTION (1.1 Å)
主引用文献Crystal structure of CdaA from Bacillus subtilis
To Be Published
8OGZ
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BU of 8ogz by Molmil
PanDDA analysis group deposition -- CdaA in complex with fragment F2X-Entry D06
分子名称: (3-methoxyphenyl)-pyrrol-1-yl-methanone, Cyclic di-AMP synthase CdaA, MAGNESIUM ION
著者Garbers, T.B, Neumann, P, Wollenhaupt, J, Weiss, M.S, Ficner, R.
登録日2023-03-20
公開日2024-03-27
実験手法X-RAY DIFFRACTION (1.14 Å)
主引用文献PanDDA analysis group deposition -- CdaA in complex with fragment F2X-Entry D06
To Be Published
8OGT
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BU of 8ogt by Molmil
PanDDA analysis group deposition -- CdaA in complex with fragment F2X-Entry C04
分子名称: 2-hydrazinyl-4-methoxypyrimidine, Cyclic di-AMP synthase CdaA, MAGNESIUM ION
著者Garbers, T.B, Neumann, P, Wollenhaupt, J, Weiss, M.S, Ficner, R.
登録日2023-03-20
公開日2024-03-27
実験手法X-RAY DIFFRACTION (1.5 Å)
主引用文献PanDDA analysis group deposition -- CdaA in complex with fragment F2X-Entry C04
To Be Published
8OGQ
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BU of 8ogq by Molmil
PanDDA analysis group deposition -- CdaA in complex with fragment F2X-Entry B06
分子名称: (1S)-1-(4-nitrophenyl)ethan-1-ol, Cyclic di-AMP synthase CdaA, MAGNESIUM ION
著者Garbers, T.B, Neumann, P, Wollenhaupt, J, Weiss, M.S, Ficner, R.
登録日2023-03-20
公開日2024-03-27
実験手法X-RAY DIFFRACTION (1.42 Å)
主引用文献PanDDA analysis group deposition -- CdaA in complex with fragment F2X-Entry B06
To Be Published
8OGP
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BU of 8ogp by Molmil
PanDDA analysis group deposition -- CdaA in complex with fragment F2X-Entry B03
分子名称: 2-[(1~{S})-1-azanylpropyl]phenol, Cyclic di-AMP synthase CdaA, MAGNESIUM ION
著者Garbers, T.B, Neumann, P, Wollenhaupt, J, Weiss, M.S, Ficner, R.
登録日2023-03-20
公開日2024-03-27
実験手法X-RAY DIFFRACTION (1.22 Å)
主引用文献PanDDA analysis group deposition -- CdaA in complex with fragment F2X-Entry B03
To Be Published
8OH1
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BU of 8oh1 by Molmil
PanDDA analysis group deposition -- CdaA in complex with fragment F2X-Entry E04
分子名称: 3-phenyl-1,2-oxazol-5-amine, Cyclic di-AMP synthase CdaA, MAGNESIUM ION
著者Garbers, T.B, Neumann, P, Wollenhaupt, J, Weiss, M.S, Ficner, R.
登録日2023-03-20
公開日2024-03-27
実験手法X-RAY DIFFRACTION (1.22 Å)
主引用文献PanDDA analysis group deposition -- CdaA in complex with fragment F2X-Entry E04
To Be Published
8OGR
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BU of 8ogr by Molmil
PanDDA analysis group deposition -- CdaA in complex with fragment F2X-Entry B07
分子名称: Cyclic di-AMP synthase CdaA, MAGNESIUM ION, N-[3-(diethylamino)phenyl]ethanamide
著者Garbers, T.B, Neumann, P, Wollenhaupt, J, Weiss, M.S, Ficner, R.
登録日2023-03-20
公開日2024-03-27
実験手法X-RAY DIFFRACTION (1.35 Å)
主引用文献PanDDA analysis group deposition -- CdaA in complex with fragment F2X-Entry B07
To Be Published
8OGY
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BU of 8ogy by Molmil
PanDDA analysis group deposition -- CdaA in complex with fragment F2X-Entry D04
分子名称: Cyclic di-AMP synthase CdaA, MAGNESIUM ION, methyl 4-fluoro-L-phenylalaninate
著者Garbers, T.B, Neumann, P, Wollenhaupt, J, Weiss, M.S, Ficner, R.
登録日2023-03-20
公開日2024-03-27
実験手法X-RAY DIFFRACTION (1.23 Å)
主引用文献PanDDA analysis group deposition -- CdaA in complex with fragment F2X-Entry D04
To Be Published
6ZWX
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BU of 6zwx by Molmil
Crystal structure of E. coli RNA helicase HrpA
分子名称: ATP-dependent RNA helicase HrpA
著者Grass, L.M, Wollenhaupt, J, Barthel, T, Loll, B, Wahl, M.C.
登録日2020-07-29
公開日2021-06-30
最終更新日2021-08-04
実験手法X-RAY DIFFRACTION (2.7 Å)
主引用文献Large-scale ratcheting in a bacterial DEAH/RHA-type RNA helicase that modulates antibiotics susceptibility.
Proc.Natl.Acad.Sci.USA, 118, 2021
6ZWW
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BU of 6zww by Molmil
Crystal structure of E. coli RNA helicase HrpA in complex with RNA
分子名称: ATP-dependent RNA helicase HrpA, CALCIUM ION, ssRNA
著者Grass, L.M, Wollenhaupt, J, Barthel, T, Loll, B, Wahl, M.C.
登録日2020-07-29
公開日2021-06-30
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (3.16 Å)
主引用文献Large-scale ratcheting in a bacterial DEAH/RHA-type RNA helicase that modulates antibiotics susceptibility.
Proc.Natl.Acad.Sci.USA, 118, 2021
7AKP
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BU of 7akp by Molmil
Crystal structure of E. coli RNA helicase HrpA-D305A
分子名称: ATP-dependent RNA helicase HrpA
著者Grass, L.M, Wollenhaupt, J, Barthel, T, Loll, B, Wahl, M.C.
登録日2020-10-01
公開日2021-06-30
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (2.59 Å)
主引用文献Large-scale ratcheting in a bacterial DEAH/RHA-type RNA helicase that modulates antibiotics susceptibility.
Proc.Natl.Acad.Sci.USA, 118, 2021
7FME
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BU of 7fme by Molmil
PanDDA analysis group deposition -- Aar2/RNaseH in complex with fragment P06C01 from the F2X-Universal Library
分子名称: 4-bromo-1-(2-methoxyethoxy)-2-nitrobenzene, A1 cistron-splicing factor AAR2, Pre-mRNA-splicing factor 8
著者Barthel, T, Wollenhaupt, J, Lima, G.M.A, Wahl, M.C, Weiss, M.S.
登録日2022-08-26
公開日2022-11-02
最終更新日2024-05-22
実験手法X-RAY DIFFRACTION (1.44 Å)
主引用文献Large-Scale Crystallographic Fragment Screening Expedites Compound Optimization and Identifies Putative Protein-Protein Interaction Sites.
J.Med.Chem., 65, 2022
7FMK
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BU of 7fmk by Molmil
PanDDA analysis group deposition -- Aar2/RNaseH in complex with fragment P06D03 from the F2X-Universal Library
分子名称: A1 cistron-splicing factor AAR2, Pre-mRNA-splicing factor 8, ethyl N-benzyl-beta-alaninate
著者Barthel, T, Wollenhaupt, J, Lima, G.M.A, Wahl, M.C, Weiss, M.S.
登録日2022-08-26
公開日2022-11-02
最終更新日2024-05-22
実験手法X-RAY DIFFRACTION (1.47 Å)
主引用文献Large-Scale Crystallographic Fragment Screening Expedites Compound Optimization and Identifies Putative Protein-Protein Interaction Sites.
J.Med.Chem., 65, 2022
7FJZ
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BU of 7fjz by Molmil
PanDDA analysis group deposition -- Aar2/RNaseH in complex with fragment P04A04 from the F2X-Universal Library
分子名称: A1 cistron-splicing factor AAR2, D-phenylalaninamide, Pre-mRNA-splicing factor 8
著者Barthel, T, Wollenhaupt, J, Lima, G.M.A, Wahl, M.C, Weiss, M.S.
登録日2022-08-26
公開日2022-11-02
最終更新日2024-05-22
実験手法X-RAY DIFFRACTION (1.54 Å)
主引用文献Large-Scale Crystallographic Fragment Screening Expedites Compound Optimization and Identifies Putative Protein-Protein Interaction Sites.
J.Med.Chem., 65, 2022
7FMQ
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BU of 7fmq by Molmil
PanDDA analysis group deposition -- Aar2/RNaseH in complex with fragment P06E04 from the F2X-Universal Library
分子名称: 3-phenoxypropanoic acid, A1 cistron-splicing factor AAR2, Pre-mRNA-splicing factor 8
著者Barthel, T, Wollenhaupt, J, Lima, G.M.A, Wahl, M.C, Weiss, M.S.
登録日2022-08-26
公開日2022-11-02
最終更新日2024-05-22
実験手法X-RAY DIFFRACTION (1.58 Å)
主引用文献Large-Scale Crystallographic Fragment Screening Expedites Compound Optimization and Identifies Putative Protein-Protein Interaction Sites.
J.Med.Chem., 65, 2022
7FK5
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BU of 7fk5 by Molmil
PanDDA analysis group deposition -- Aar2/RNaseH in complex with fragment P04A12 from the F2X-Universal Library
分子名称: (5S)-5-methyl-5-phenylimidazolidine-2,4-dione, A1 cistron-splicing factor AAR2, Pre-mRNA-splicing factor 8
著者Barthel, T, Wollenhaupt, J, Lima, G.M.A, Wahl, M.C, Weiss, M.S.
登録日2022-08-26
公開日2022-11-02
最終更新日2024-05-22
実験手法X-RAY DIFFRACTION (1.53 Å)
主引用文献Large-Scale Crystallographic Fragment Screening Expedites Compound Optimization and Identifies Putative Protein-Protein Interaction Sites.
J.Med.Chem., 65, 2022
7FMW
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BU of 7fmw by Molmil
PanDDA analysis group deposition -- Aar2/RNaseH in complex with fragment P06F06 from the F2X-Universal Library
分子名称: 3-phenyl-1,2-oxazole-5-carboxylic acid, A1 cistron-splicing factor AAR2, Pre-mRNA-splicing factor 8
著者Barthel, T, Wollenhaupt, J, Lima, G.M.A, Wahl, M.C, Weiss, M.S.
登録日2022-08-26
公開日2022-11-02
最終更新日2024-05-22
実験手法X-RAY DIFFRACTION (1.51 Å)
主引用文献Large-Scale Crystallographic Fragment Screening Expedites Compound Optimization and Identifies Putative Protein-Protein Interaction Sites.
J.Med.Chem., 65, 2022
7FKA
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BU of 7fka by Molmil
PanDDA analysis group deposition -- Aar2/RNaseH in complex with fragment P04C04 from the F2X-Universal Library
分子名称: A1 cistron-splicing factor AAR2, Pre-mRNA-splicing factor 8, methyl N-(2-chlorobenzoyl)glycinate
著者Barthel, T, Wollenhaupt, J, Lima, G.M.A, Wahl, M.C, Weiss, M.S.
登録日2022-08-26
公開日2022-11-02
最終更新日2024-05-22
実験手法X-RAY DIFFRACTION (1.55 Å)
主引用文献Large-Scale Crystallographic Fragment Screening Expedites Compound Optimization and Identifies Putative Protein-Protein Interaction Sites.
J.Med.Chem., 65, 2022
7FN4
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BU of 7fn4 by Molmil
PanDDA analysis group deposition -- Aar2/RNaseH in complex with fragment P06G11 from the F2X-Universal Library
分子名称: A1 cistron-splicing factor AAR2, Pre-mRNA-splicing factor 8, ethyl pyridin-3-ylcarbamate
著者Barthel, T, Wollenhaupt, J, Lima, G.M.A, Wahl, M.C, Weiss, M.S.
登録日2022-08-26
公開日2022-11-02
最終更新日2024-05-22
実験手法X-RAY DIFFRACTION (1.72 Å)
主引用文献Large-Scale Crystallographic Fragment Screening Expedites Compound Optimization and Identifies Putative Protein-Protein Interaction Sites.
J.Med.Chem., 65, 2022
7FNA
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BU of 7fna by Molmil
PanDDA analysis group deposition -- Aar2/RNaseH in complex with fragment P07A11 from the F2X-Universal Library
分子名称: 3-bromo-4-methoxy-N-methylbenzene-1-sulfonamide, A1 cistron-splicing factor AAR2, Pre-mRNA-splicing factor 8
著者Barthel, T, Wollenhaupt, J, Lima, G.M.A, Wahl, M.C, Weiss, M.S.
登録日2022-08-26
公開日2022-11-02
最終更新日2024-05-22
実験手法X-RAY DIFFRACTION (1.69 Å)
主引用文献Large-Scale Crystallographic Fragment Screening Expedites Compound Optimization and Identifies Putative Protein-Protein Interaction Sites.
J.Med.Chem., 65, 2022
7FKF
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BU of 7fkf by Molmil
PanDDA analysis group deposition -- Aar2/RNaseH in complex with fragment P04D04 from the F2X-Universal Library
分子名称: A1 cistron-splicing factor AAR2, N'-(2-bromophenyl)-N,N-dimethylsulfuric diamide, Pre-mRNA-splicing factor 8
著者Barthel, T, Wollenhaupt, J, Lima, G.M.A, Wahl, M.C, Weiss, M.S.
登録日2022-08-26
公開日2022-11-02
最終更新日2022-11-30
実験手法X-RAY DIFFRACTION (1.69 Å)
主引用文献Large-Scale Crystallographic Fragment Screening Expedites Compound Optimization and Identifies Putative Protein-Protein Interaction Sites.
J.Med.Chem., 65, 2022
7FNG
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BU of 7fng by Molmil
PanDDA analysis group deposition -- Aar2/RNaseH in complex with fragment P07B12 from the F2X-Universal Library
分子名称: A1 cistron-splicing factor AAR2, N-(2-AMINOETHYL)-P-CHLOROBENZAMIDE, Pre-mRNA-splicing factor 8
著者Barthel, T, Wollenhaupt, J, Lima, G.M.A, Wahl, M.C, Weiss, M.S.
登録日2022-08-26
公開日2022-11-02
最終更新日2024-05-22
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献Large-Scale Crystallographic Fragment Screening Expedites Compound Optimization and Identifies Putative Protein-Protein Interaction Sites.
J.Med.Chem., 65, 2022
7FKL
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BU of 7fkl by Molmil
PanDDA analysis group deposition -- Aar2/RNaseH in complex with fragment P04E02 from the F2X-Universal Library
分子名称: (2S)-2-phenoxypropanehydrazide, A1 cistron-splicing factor AAR2, Pre-mRNA-splicing factor 8
著者Barthel, T, Wollenhaupt, J, Lima, G.M.A, Wahl, M.C, Weiss, M.S.
登録日2022-08-26
公開日2022-11-02
最終更新日2024-05-22
実験手法X-RAY DIFFRACTION (1.63 Å)
主引用文献Large-Scale Crystallographic Fragment Screening Expedites Compound Optimization and Identifies Putative Protein-Protein Interaction Sites.
J.Med.Chem., 65, 2022

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件を2024-05-22に公開中

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