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PDB: 71 results

9GRT
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BU of 9grt by Molmil
Crystal structure of HRP-2 PWWP domain in complex with compound 29
Descriptor: 4-bromo-1H-pyrazole, DIMETHYL SULFOXIDE, Hepatoma-derived growth factor-related protein 2, ...
Authors:Osipov, E.M, Paulovcakova, T, Beelen, S, Vantieghem, T, Strelkov, S.V.
Deposit date:2024-09-12
Release date:2024-11-06
Method:X-RAY DIFFRACTION (1.64 Å)
Cite:Rational fragment-based design of compounds targeting the PWWP domain of the HRP family.
Eur.J.Med.Chem., 280, 2024
9G91
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BU of 9g91 by Molmil
Crystal structure of HRP-2 PWWP domain in complex with compound 43
Descriptor: 1,2-ETHANEDIOL, Hepatoma-derived growth factor-related protein 2, SULFATE ION, ...
Authors:Vantieghem, T, Osipov, E.M, Strelkov, S.V.
Deposit date:2024-07-24
Release date:2024-11-06
Method:X-RAY DIFFRACTION (1.78 Å)
Cite:Rational fragment-based design of compounds targeting the PWWP domain of the HRP family.
Eur.J.Med.Chem., 280, 2024
9G96
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BU of 9g96 by Molmil
Crystal structure of HRP-2 PWWP domain in complex with compound 42
Descriptor: 1,2-ETHANEDIOL, 4-[[(5-bromanylpyridin-3-yl)methylamino]methyl]aniline, Hepatoma-derived growth factor-related protein 2, ...
Authors:Vantieghem, T, Osipov, E.M, Strelkov, S.V.
Deposit date:2024-07-24
Release date:2024-11-06
Method:X-RAY DIFFRACTION (1.94 Å)
Cite:Rational fragment-based design of compounds targeting the PWWP domain of the HRP family.
Eur.J.Med.Chem., 280, 2024
9G94
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BU of 9g94 by Molmil
Crystal structure of HRP-2 PWWP domain in complex with compound 32
Descriptor: 4-(4-bromanyl-1~{H}-pyrazol-3-yl)pyridine, Hepatoma-derived growth factor-related protein 2, SULFATE ION
Authors:Osipov, E.M, Vantieghem, T, Strelkov, S.V.
Deposit date:2024-07-24
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
9GRU
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BU of 9gru by Molmil
Crystal structure of HRP-2 PWWP domain in complex with compound 30
Descriptor: 4-IODOPYRAZOLE, Hepatoma-derived growth factor-related protein 2, SULFATE ION
Authors:Osipov, E.M, Paulovcakova, T, Beelen, S, Vantieghem, T, Strelkov, S.V.
Deposit date:2024-09-12
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
9GRS
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BU of 9grs by Molmil
Crystal structure of HRP-2 PWWP domain in complex with compound 8
Descriptor: 1-bromanyl-4-methylsulfonyl-benzene, DIMETHYL SULFOXIDE, Hepatoma-derived growth factor-related protein 2, ...
Authors:Osipov, E.M, Paulovcakova, T, Beelen, S, Vantieghem, T, Strelkov, S.V.
Deposit date:2024-09-12
Release date:2024-11-06
Method:X-RAY DIFFRACTION (1.66 Å)
Cite:Rational fragment-based design of compounds targeting the PWWP domain of the HRP family.
Eur.J.Med.Chem., 280, 2024
9GRV
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BU of 9grv by Molmil
Crystal structure of HRP-2 PWWP domain in complex with compound 37
Descriptor: 5-bromanylpyrimidine, DIMETHYL SULFOXIDE, Hepatoma-derived growth factor-related protein 2, ...
Authors:Osipov, E.M, Paulovcakova, T, Beelen, S, Vantieghem, T, Strelkov, S.V.
Deposit date:2024-09-12
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
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
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
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
7HGZ
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BU of 7hgz by Molmil
PanDDA analysis group deposition -- Crystal structure of HRP-2 PWWP domain in complex with Z1509882419
Descriptor: 1,2-ETHANEDIOL, 1-(propan-2-yl)-1H-imidazole-4-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 (1.65 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
7HH4
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BU of 7hh4 by Molmil
PanDDA analysis group deposition -- Crystal structure of HRP-2 PWWP domain in complex with Z1139246057
Descriptor: (3R)-N-methyl-1-(pyridazin-3-yl)piperidin-3-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 (1.49 Å)
Cite:Rational fragment-based design of compounds targeting the PWWP domain of the HRP family.
Eur.J.Med.Chem., 280, 2024
7HHO
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BU of 7hho by Molmil
PanDDA analysis group deposition -- Crystal structure of HRP-2 PWWP domain in complex with Z235361315
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
7HHI
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BU of 7hhi by Molmil
PanDDA analysis group deposition -- Crystal structure of HRP-2 PWWP domain in complex with Z805551440
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 (2.11 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
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
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
7HGX
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BU of 7hgx by Molmil
PanDDA analysis group deposition -- Crystal structure of HRP-2 PWWP domain in complex with Z1362754425
Descriptor: (2R)-1-(2-methyl-1H-imidazol-1-yl)propan-2-ol, 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 (1.57 Å)
Cite:Rational fragment-based design of compounds targeting the PWWP domain of the HRP family.
Eur.J.Med.Chem., 280, 2024
7HHE
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BU of 7hhe by Molmil
PanDDA analysis group deposition -- Crystal structure of HRP-2 PWWP domain in complex with Z1203252645
Descriptor: 1,2-ETHANEDIOL, Hepatoma-derived growth factor-related protein 2, N-methyl-N-(pyridin-3-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 (2.04 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
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
7HGW
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BU of 7hgw by Molmil
PanDDA analysis group deposition -- Crystal structure of HRP-2 PWWP domain in complex with Z1407673036
Descriptor: (2R)-2-phenylpropane-1-sulfonamide, 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 (1.59 Å)
Cite:Rational fragment-based design of compounds targeting the PWWP domain of the HRP family.
Eur.J.Med.Chem., 280, 2024
7HGV
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BU of 7hgv by Molmil
PanDDA analysis group deposition -- Crystal structure of HRP-2 PWWP domain in complex with Z103740620
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 (1.48 Å)
Cite:Rational fragment-based design of compounds targeting the PWWP domain of the HRP family.
Eur.J.Med.Chem., 280, 2024
7HHC
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BU of 7hhc by Molmil
PanDDA analysis group deposition -- Crystal structure of HRP-2 PWWP domain in complex with Z31432964
Descriptor: (4-methylpiperazin-1-yl)[(2R)-oxolan-2-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 (1.59 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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