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New PDB entries with X-ray structure factor data
7HG0
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BU of 7hg0 by Molmil
PanDDA analysis group deposition -- Crystal structure of HRP-2 PWWP domain in complex with Z46169212
Descriptor: 1,2-ETHANEDIOL, Hepatoma-derived growth factor-related protein 2, N-(4-acetylphenyl)-2-(pyrrolidin-1-yl)acetamide, ...
Authors:Vantieghem, T, Osipov, E, Fearon, D, Douangamath, A, von Delft, F, Strelkov, S.
Deposit date:2024-08-29
Release date:2024-11-06
Method:X-RAY DIFFRACTION (1.58 Å)
Cite:Rational fragment-based design of compounds targeting the PWWP domain of the HRP family.
Eur.J.Med.Chem., 280, 2024
7HG1
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BU of 7hg1 by Molmil
PanDDA analysis group deposition -- Crystal structure of HRP-2 PWWP domain in complex with Z1079512010
Descriptor: 1,2-ETHANEDIOL, 6-methyl-2-[(3-methyl-1,2-oxazol-5-yl)methyl]pyridazin-3(2H)-one, Hepatoma-derived growth factor-related protein 2, ...
Authors:Vantieghem, T, Osipov, E, Fearon, D, Douangamath, A, von Delft, F, Strelkov, S.
Deposit date:2024-08-29
Release date:2024-11-06
Method:X-RAY DIFFRACTION (1.81 Å)
Cite:Rational fragment-based design of compounds targeting the PWWP domain of the HRP family.
Eur.J.Med.Chem., 280, 2024
7HG2
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BU of 7hg2 by Molmil
PanDDA analysis group deposition -- Crystal structure of HRP-2 PWWP domain in complex with Z1401276297
Descriptor: (5S)-7-(pyrazin-2-yl)-2-oxa-7-azaspiro[4.4]nonane, (5~{R})-7-pyrazin-2-yl-2-oxa-7-azaspiro[4.4]nonane, 1,2-ETHANEDIOL, ...
Authors:Vantieghem, T, Osipov, E, Fearon, D, Douangamath, A, von Delft, F, Strelkov, S.
Deposit date:2024-08-29
Release date:2024-11-06
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Rational fragment-based design of compounds targeting the PWWP domain of the HRP family.
Eur.J.Med.Chem., 280, 2024
7HG3
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BU of 7hg3 by Molmil
PanDDA analysis group deposition -- Crystal structure of HRP-2 PWWP domain in complex with Z319891284
Descriptor: 1,2-ETHANEDIOL, 3-[(2S)-1-(methanesulfonyl)pyrrolidin-2-yl]-5-methyl-1,2-oxazole, Hepatoma-derived growth factor-related protein 2, ...
Authors:Vantieghem, T, Osipov, E, Fearon, D, Douangamath, A, von Delft, F, Strelkov, S.
Deposit date:2024-08-29
Release date:2024-11-06
Method:X-RAY DIFFRACTION (1.45 Å)
Cite:Rational fragment-based design of compounds targeting the PWWP domain of the HRP family.
Eur.J.Med.Chem., 280, 2024
7HG4
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BU of 7hg4 by Molmil
PanDDA analysis group deposition -- Crystal structure of HRP-2 PWWP domain in complex with Z1696844792
Descriptor: 1,2-ETHANEDIOL, 1-(diphenylmethyl)azetidin-3-ol, Hepatoma-derived growth factor-related protein 2, ...
Authors:Vantieghem, T, Osipov, E, Fearon, D, Douangamath, A, von Delft, F, Strelkov, S.
Deposit date:2024-08-29
Release date:2024-11-06
Method:X-RAY DIFFRACTION (1.57 Å)
Cite:Rational fragment-based design of compounds targeting the PWWP domain of the HRP family.
Eur.J.Med.Chem., 280, 2024
7HG5
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BU of 7hg5 by Molmil
PanDDA analysis group deposition -- Crystal structure of HRP-2 PWWP domain in complex with Z2142244288
Descriptor: 1,2-ETHANEDIOL, Hepatoma-derived growth factor-related protein 2, N-ethyl-2-fluoro-4-(methylsulfonyl)aniline, ...
Authors:Vantieghem, T, Osipov, E, Fearon, D, Douangamath, A, von Delft, F, Strelkov, S.
Deposit date:2024-08-29
Release date:2024-11-06
Method:X-RAY DIFFRACTION (1.57 Å)
Cite:Rational fragment-based design of compounds targeting the PWWP domain of the HRP family.
Eur.J.Med.Chem., 280, 2024
7HG6
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BU of 7hg6 by Molmil
PanDDA analysis group deposition -- Crystal structure of HRP-2 PWWP domain in complex with Z839706072
Descriptor: 1,2-ETHANEDIOL, 2-(4-bromanylpyrazol-1-yl)-~{N}-cyclopropyl-~{N}-methyl-ethanamide, Hepatoma-derived growth factor-related protein 2, ...
Authors:Vantieghem, T, Osipov, E, Fearon, D, Douangamath, A, von Delft, F, Strelkov, S.
Deposit date:2024-08-29
Release date:2024-11-06
Method:X-RAY DIFFRACTION (1.52 Å)
Cite:Rational fragment-based design of compounds targeting the PWWP domain of the HRP family.
Eur.J.Med.Chem., 280, 2024
7HG7
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BU of 7hg7 by Molmil
PanDDA analysis group deposition -- Crystal structure of HRP-2 PWWP domain in complex with Z46169164
Descriptor: 1,2-ETHANEDIOL, Hepatoma-derived growth factor-related protein 2, SULFATE ION, ...
Authors:Vantieghem, T, Osipov, E, Fearon, D, Douangamath, A, von Delft, F, Strelkov, S.
Deposit date:2024-08-29
Release date:2024-11-06
Method:X-RAY DIFFRACTION (1.76 Å)
Cite:Rational fragment-based design of compounds targeting the PWWP domain of the HRP family.
Eur.J.Med.Chem., 280, 2024
7HG8
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BU of 7hg8 by Molmil
PanDDA analysis group deposition -- Crystal structure of HRP-2 PWWP domain in complex with Z445856640
Descriptor: 1,2-ETHANEDIOL, Hepatoma-derived growth factor-related protein 2, N-[(3R)-1,1-dioxo-1lambda~6~-thiolan-3-yl]-N-methyl-N'-propan-2-ylurea, ...
Authors:Vantieghem, T, Osipov, E, Fearon, D, Douangamath, A, von Delft, F, Strelkov, S.
Deposit date:2024-08-29
Release date:2024-11-06
Method:X-RAY DIFFRACTION (1.67 Å)
Cite:Rational fragment-based design of compounds targeting the PWWP domain of the HRP family.
Eur.J.Med.Chem., 280, 2024
7HG9
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BU of 7hg9 by Molmil
PanDDA analysis group deposition -- Crystal structure of HRP-2 PWWP domain in complex with Z131516158
Descriptor: 1,2-ETHANEDIOL, Hepatoma-derived growth factor-related protein 2, N-{(1R)-1-[(4S)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]ethyl}acetamide, ...
Authors:Vantieghem, T, Osipov, E, Fearon, D, Douangamath, A, von Delft, F, Strelkov, S.
Deposit date:2024-08-29
Release date:2024-11-06
Method:X-RAY DIFFRACTION (1.58 Å)
Cite:Rational fragment-based design of compounds targeting the PWWP domain of the HRP family.
Eur.J.Med.Chem., 280, 2024
7HGA
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BU of 7hga by Molmil
PanDDA analysis group deposition -- Crystal structure of HRP-2 PWWP domain in complex with Z1980894300
Descriptor: 1,2-ETHANEDIOL, Hepatoma-derived growth factor-related protein 2, SULFATE ION, ...
Authors:Vantieghem, T, Osipov, E, Fearon, D, Douangamath, A, von Delft, F, Strelkov, S.
Deposit date:2024-08-29
Release date:2024-11-06
Method:X-RAY DIFFRACTION (1.57 Å)
Cite:Rational fragment-based design of compounds targeting the PWWP domain of the HRP family.
Eur.J.Med.Chem., 280, 2024
7HGB
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BU of 7hgb by Molmil
PanDDA analysis group deposition -- Crystal structure of HRP-2 PWWP domain in complex with Z33297786
Descriptor: 1,2-ETHANEDIOL, 2-methoxy-N-[(4-methylphenyl)methyl]acetamide, Hepatoma-derived growth factor-related protein 2, ...
Authors:Vantieghem, T, Osipov, E, Fearon, D, Douangamath, A, von Delft, F, Strelkov, S.
Deposit date:2024-08-29
Release date:2024-11-06
Method:X-RAY DIFFRACTION (1.52 Å)
Cite:Rational fragment-based design of compounds targeting the PWWP domain of the HRP family.
Eur.J.Med.Chem., 280, 2024
7HGC
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BU of 7hgc by Molmil
PanDDA analysis group deposition -- Crystal structure of HRP-2 PWWP domain in complex with Z1428159350
Descriptor: (1S)-1-(1-phenyl-1H-1,2,3-triazol-4-yl)ethan-1-amine, 1,2-ETHANEDIOL, Hepatoma-derived growth factor-related protein 2, ...
Authors:Vantieghem, T, Osipov, E, Fearon, D, Douangamath, A, von Delft, F, Strelkov, S.
Deposit date:2024-08-29
Release date:2024-11-06
Method:X-RAY DIFFRACTION (1.51 Å)
Cite:Rational fragment-based design of compounds targeting the PWWP domain of the HRP family.
Eur.J.Med.Chem., 280, 2024
7HGD
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BU of 7hgd by Molmil
PanDDA analysis group deposition -- Crystal structure of HRP-2 PWWP domain in complex with Z363071686
Descriptor: 1,2-ETHANEDIOL, Hepatoma-derived growth factor-related protein 2, N-methyl-N-[2-oxo-2-(piperidin-1-yl)ethyl]methanesulfonamide, ...
Authors:Vantieghem, T, Osipov, E, Fearon, D, Douangamath, A, von Delft, F, Strelkov, S.
Deposit date:2024-08-29
Release date:2024-11-06
Method:X-RAY DIFFRACTION (1.65 Å)
Cite:Rational fragment-based design of compounds targeting the PWWP domain of the HRP family.
Eur.J.Med.Chem., 280, 2024
7HGE
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BU of 7hge by Molmil
PanDDA analysis group deposition -- Crystal structure of HRP-2 PWWP domain in complex with Z45527714
Descriptor: 1,2-ETHANEDIOL, 2-chloro-N-methylbenzene-1-sulfonamide, Hepatoma-derived growth factor-related protein 2, ...
Authors:Vantieghem, T, Osipov, E, Fearon, D, Douangamath, A, von Delft, F, Strelkov, S.
Deposit date:2024-08-29
Release date:2024-11-06
Method:X-RAY DIFFRACTION (1.77 Å)
Cite:Rational fragment-based design of compounds targeting the PWWP domain of the HRP family.
Eur.J.Med.Chem., 280, 2024
7HGF
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BU of 7hgf by Molmil
PanDDA analysis group deposition -- Crystal structure of HRP-2 PWWP domain in complex with Z1262433643
Descriptor: 1,2-ETHANEDIOL, 1-[(thiophen-3-yl)methyl]piperidin-4-ol, Hepatoma-derived growth factor-related protein 2, ...
Authors:Vantieghem, T, Osipov, E, Fearon, D, Douangamath, A, von Delft, F, Strelkov, S.
Deposit date:2024-08-29
Release date:2024-11-06
Method:X-RAY DIFFRACTION (1.55 Å)
Cite:Rational fragment-based design of compounds targeting the PWWP domain of the HRP family.
Eur.J.Med.Chem., 280, 2024
7HGG
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BU of 7hgg by Molmil
PanDDA analysis group deposition -- Crystal structure of HRP-2 PWWP domain in complex with Z422396686
Descriptor: 1,2-ETHANEDIOL, Hepatoma-derived growth factor-related protein 2, SULFATE ION, ...
Authors:Vantieghem, T, Osipov, E, Fearon, D, Douangamath, A, von Delft, F, Strelkov, S.
Deposit date:2024-08-29
Release date:2024-11-06
Method:X-RAY DIFFRACTION (1.61 Å)
Cite:Rational fragment-based design of compounds targeting the PWWP domain of the HRP family.
Eur.J.Med.Chem., 280, 2024
7HGH
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BU of 7hgh by Molmil
PanDDA analysis group deposition -- Crystal structure of HRP-2 PWWP domain in complex with Z26823525
Descriptor: (2S)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)oxolane-2-carboxamide, 1,2-ETHANEDIOL, Hepatoma-derived growth factor-related protein 2, ...
Authors:Vantieghem, T, Osipov, E, Fearon, D, Douangamath, A, von Delft, F, Strelkov, S.
Deposit date:2024-08-29
Release date:2024-11-06
Method:X-RAY DIFFRACTION (1.74 Å)
Cite:Rational fragment-based design of compounds targeting the PWWP domain of the HRP family.
Eur.J.Med.Chem., 280, 2024
7HGI
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BU of 7hgi by Molmil
PanDDA analysis group deposition -- Crystal structure of HRP-2 PWWP domain in complex with Z57475068
Descriptor: 1,2-ETHANEDIOL, Hepatoma-derived growth factor-related protein 2, N~1~,N~1~,N~4~,N~4~-tetramethylpiperazine-1,4-dicarboxamide, ...
Authors:Vantieghem, T, Osipov, E, Fearon, D, Douangamath, A, von Delft, F, Strelkov, S.
Deposit date:2024-08-29
Release date:2024-11-06
Method:X-RAY DIFFRACTION (1.71 Å)
Cite:Rational fragment-based design of compounds targeting the PWWP domain of the HRP family.
Eur.J.Med.Chem., 280, 2024
7HGJ
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BU of 7hgj by Molmil
PanDDA analysis group deposition -- Crystal structure of HRP-2 PWWP domain in complex with Z751811134
Descriptor: 1,2-ETHANEDIOL, Hepatoma-derived growth factor-related protein 2, N,N-dimethylpyridine-3-sulfonamide, ...
Authors:Vantieghem, T, Osipov, E, Fearon, D, Douangamath, A, von Delft, F, Strelkov, S.
Deposit date:2024-08-29
Release date:2024-11-06
Method:X-RAY DIFFRACTION (1.75 Å)
Cite:Rational fragment-based design of compounds targeting the PWWP domain of the HRP family.
Eur.J.Med.Chem., 280, 2024
7HGK
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BU of 7hgk by Molmil
PanDDA analysis group deposition -- Crystal structure of HRP-2 PWWP domain in complex with Z31721798
Descriptor: 1,2-ETHANEDIOL, 3-cyclohexyl-1-(morpholin-4-yl)propan-1-one, Hepatoma-derived growth factor-related protein 2, ...
Authors:Vantieghem, T, Osipov, E, Fearon, D, Douangamath, A, von Delft, F, Strelkov, S.
Deposit date:2024-08-29
Release date:2024-11-06
Method:X-RAY DIFFRACTION (1.59 Å)
Cite:Rational fragment-based design of compounds targeting the PWWP domain of the HRP family.
Eur.J.Med.Chem., 280, 2024
7HGL
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BU of 7hgl by Molmil
PanDDA analysis group deposition -- Crystal structure of HRP-2 PWWP domain in complex with Z137790394
Descriptor: 1,2-ETHANEDIOL, 4-[(5-chloro-1,2,3-thiadiazol-4-yl)methyl]morpholine, Hepatoma-derived growth factor-related protein 2, ...
Authors:Vantieghem, T, Osipov, E, Fearon, D, Douangamath, A, von Delft, F, Strelkov, S.
Deposit date:2024-08-29
Release date:2024-11-06
Method:X-RAY DIFFRACTION (1.73 Å)
Cite:Rational fragment-based design of compounds targeting the PWWP domain of the HRP family.
Eur.J.Med.Chem., 280, 2024
7HGM
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BU of 7hgm by Molmil
PanDDA analysis group deposition -- Crystal structure of HRP-2 PWWP domain in complex with Z438067480
Descriptor: 1,2-ETHANEDIOL, Hepatoma-derived growth factor-related protein 2, N-{[(4R)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyridin-3-yl]methyl}propanamide, ...
Authors:Vantieghem, T, Osipov, E, Fearon, D, Douangamath, A, von Delft, F, Strelkov, S.
Deposit date:2024-08-29
Release date:2024-11-06
Method:X-RAY DIFFRACTION (1.61 Å)
Cite:Rational fragment-based design of compounds targeting the PWWP domain of the HRP family.
Eur.J.Med.Chem., 280, 2024
7HGN
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BU of 7hgn by Molmil
PanDDA analysis group deposition -- Crystal structure of HRP-2 PWWP domain in complex with Z54226006
Descriptor: (2,6-difluorophenyl)(pyrrolidin-1-yl)methanone, 1,2-ETHANEDIOL, Hepatoma-derived growth factor-related protein 2, ...
Authors:Vantieghem, T, Osipov, E, Fearon, D, Douangamath, A, von Delft, F, Strelkov, S.
Deposit date:2024-08-29
Release date:2024-11-06
Method:X-RAY DIFFRACTION (1.55 Å)
Cite:Rational fragment-based design of compounds targeting the PWWP domain of the HRP family.
Eur.J.Med.Chem., 280, 2024
7HGO
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BU of 7hgo by Molmil
PanDDA analysis group deposition -- Crystal structure of HRP-2 PWWP domain in complex with Z431807512
Descriptor: 1,2-ETHANEDIOL, Hepatoma-derived growth factor-related protein 2, N-methyl-3-oxo-N-(propan-2-yl)piperazine-1-sulfonamide, ...
Authors:Vantieghem, T, Osipov, E, Fearon, D, Douangamath, A, von Delft, F, Strelkov, S.
Deposit date:2024-08-29
Release date:2024-11-06
Method:X-RAY DIFFRACTION (1.44 Å)
Cite:Rational fragment-based design of compounds targeting the PWWP domain of the HRP family.
Eur.J.Med.Chem., 280, 2024

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數據於2024-11-06公開中

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