7PWQ
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![BU of 7pwq by Molmil](/molmil-images/mine/7pwq) | PARP15 catalytic domain in complex with OUL240 | 分子名称: | (4S)-2-METHYL-2,4-PENTANEDIOL, 6-(cyclohexylmethoxy)phthalazine-1,4-dione, Protein mono-ADP-ribosyltransferase PARP15 | 著者 | Maksimainen, M.M, Lehtio, L. | 登録日 | 2021-10-07 | 公開日 | 2022-05-11 | 最終更新日 | 2024-01-31 | 実験手法 | X-RAY DIFFRACTION (1.7 Å) | 主引用文献 | Potent 2,3-dihydrophthalazine-1,4-dione derivatives as dual inhibitors for mono-ADP-ribosyltransferases PARP10 and PARP15. Eur.J.Med.Chem., 237, 2022
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7PWK
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![BU of 7pwk by Molmil](/molmil-images/mine/7pwk) | PARP15 catalytic domain in complex with OUL239 | 分子名称: | 4-(cyclopropylmethoxy)benzamide, Protein mono-ADP-ribosyltransferase PARP15 | 著者 | Maksimainen, M.M, Lehtio, L. | 登録日 | 2021-10-07 | 公開日 | 2022-05-11 | 最終更新日 | 2024-01-31 | 実験手法 | X-RAY DIFFRACTION (1.8 Å) | 主引用文献 | Potent 2,3-dihydrophthalazine-1,4-dione derivatives as dual inhibitors for mono-ADP-ribosyltransferases PARP10 and PARP15. Eur.J.Med.Chem., 237, 2022
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7PWW
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![BU of 7pww by Molmil](/molmil-images/mine/7pww) | PARP15 catalytic domain in complex with OUL224 | 分子名称: | 6-[(3-bromophenyl)methoxy]phthalazine-1,4-dione, Protein mono-ADP-ribosyltransferase PARP15 | 著者 | Maksimainen, M.M, Murthy, S, Nizi, M.G, Lehtio, L. | 登録日 | 2021-10-07 | 公開日 | 2022-05-11 | 最終更新日 | 2024-01-31 | 実験手法 | X-RAY DIFFRACTION (2.15 Å) | 主引用文献 | Potent 2,3-dihydrophthalazine-1,4-dione derivatives as dual inhibitors for mono-ADP-ribosyltransferases PARP10 and PARP15. Eur.J.Med.Chem., 237, 2022
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7R5D
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![BU of 7r5d by Molmil](/molmil-images/mine/7r5d) | PARP15 catalytic domain in complex with OUL234 | 分子名称: | 6-propan-2-yl-[1,2,4]triazolo[3,4-b][1,3]benzothiazole, DIMETHYL SULFOXIDE, Protein mono-ADP-ribosyltransferase PARP15 | 著者 | Maksimainen, M.M, Lehtio, L. | 登録日 | 2022-02-10 | 公開日 | 2023-01-25 | 最終更新日 | 2024-02-07 | 実験手法 | X-RAY DIFFRACTION (2.15 Å) | 主引用文献 | [1,2,4]Triazolo[3,4- b ]benzothiazole Scaffold as Versatile Nicotinamide Mimic Allowing Nanomolar Inhibition of Different PARP Enzymes. J.Med.Chem., 66, 2023
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7R3L
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![BU of 7r3l by Molmil](/molmil-images/mine/7r3l) | PARP14 catalytic domain in complex with OUL40 | 分子名称: | 6-methyl-[1,2,4]triazolo[3,4-b][1,3]benzothiazole, CHLORIDE ION, Poly [ADP-ribose] polymerase 14, ... | 著者 | Maksimainen, M.M, Murthy, S, Lehtio, L. | 登録日 | 2022-02-07 | 公開日 | 2023-01-25 | 最終更新日 | 2024-02-07 | 実験手法 | X-RAY DIFFRACTION (2 Å) | 主引用文献 | [1,2,4]Triazolo[3,4- b ]benzothiazole Scaffold as Versatile Nicotinamide Mimic Allowing Nanomolar Inhibition of Different PARP Enzymes. J.Med.Chem., 66, 2023
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7R3O
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![BU of 7r3o by Molmil](/molmil-images/mine/7r3o) | PARP15 catalytic domain in complex with OUL40 | 分子名称: | 6-methyl-[1,2,4]triazolo[3,4-b][1,3]benzothiazole, DIMETHYL SULFOXIDE, Protein mono-ADP-ribosyltransferase PARP15 | 著者 | Maksimainen, M.M, Murthy, S, Lehtio, L. | 登録日 | 2022-02-07 | 公開日 | 2023-01-25 | 最終更新日 | 2024-02-07 | 実験手法 | X-RAY DIFFRACTION (2.2 Å) | 主引用文献 | [1,2,4]Triazolo[3,4- b ]benzothiazole Scaffold as Versatile Nicotinamide Mimic Allowing Nanomolar Inhibition of Different PARP Enzymes. J.Med.Chem., 66, 2023
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7AEO
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![BU of 7aeo by Molmil](/molmil-images/mine/7aeo) | Human ARTD2 in complex with DNA oligonucleotides | 分子名称: | DNA, Poly [ADP-ribose] polymerase 2, SULFATE ION | 著者 | Obaji, E, Maksimainen, M.M, Galera-Prat, A, Lehtio, L. | 登録日 | 2020-09-17 | 公開日 | 2021-05-19 | 最終更新日 | 2024-01-31 | 実験手法 | X-RAY DIFFRACTION (2.8 Å) | 主引用文献 | Activation of PARP2/ARTD2 by DNA damage induces conformational changes relieving enzyme autoinhibition. Nat Commun, 12, 2021
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6Y4Z
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![BU of 6y4z by Molmil](/molmil-images/mine/6y4z) | The crystal structure of human MACROD2 in space group P43212 | 分子名称: | L(+)-TARTARIC ACID, Thioredoxin 1,ADP-ribose glycohydrolase MACROD2 | 著者 | Wazir, S, Maksimainen, M.M, Lehtio, L. | 登録日 | 2020-02-24 | 公開日 | 2020-09-30 | 最終更新日 | 2024-01-24 | 実験手法 | X-RAY DIFFRACTION (1.9 Å) | 主引用文献 | Multiple crystal forms of human MacroD2. Acta Crystallogr.,Sect.F, 76, 2020
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6Y4Y
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![BU of 6y4y by Molmil](/molmil-images/mine/6y4y) | The crystal structure of human MACROD2 in space group P41212 | 分子名称: | L(+)-TARTARIC ACID, Thioredoxin 1,ADP-ribose glycohydrolase MACROD2 | 著者 | Wazir, S, Maksimainen, M.M, Lehtio, L. | 登録日 | 2020-02-24 | 公開日 | 2020-09-30 | 最終更新日 | 2024-01-24 | 実験手法 | X-RAY DIFFRACTION (1.75 Å) | 主引用文献 | Multiple crystal forms of human MacroD2. Acta Crystallogr.,Sect.F, 76, 2020
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6Y73
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![BU of 6y73 by Molmil](/molmil-images/mine/6y73) | The crystal structure of human MACROD2 in space group P43 | 分子名称: | ADP-ribose glycohydrolase MACROD2, DIMETHYL SULFOXIDE, GLYCEROL, ... | 著者 | Wazir, S, Maksimainen, M.M, Lehtio, L. | 登録日 | 2020-02-28 | 公開日 | 2020-09-30 | 最終更新日 | 2024-01-24 | 実験手法 | X-RAY DIFFRACTION (1.7 Å) | 主引用文献 | Multiple crystal forms of human MacroD2. Acta Crystallogr.,Sect.F, 76, 2020
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6RHT
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![BU of 6rht by Molmil](/molmil-images/mine/6rht) | Structure of Pediococcus acidilactici putative lactate oxidase WT protein | 分子名称: | FLAVIN MONONUCLEOTIDE, GLYCEROL, Putative L-lactate oxidase | 著者 | Ashok, Y, Maksimainen, M.M, Kilpelainen, P, Lehtio, L. | 登録日 | 2019-04-22 | 公開日 | 2020-02-12 | 最終更新日 | 2024-01-24 | 実験手法 | X-RAY DIFFRACTION (1.9 Å) | 主引用文献 | FMN-dependent oligomerization of putative lactate oxidase from Pediococcus acidilactici. Plos One, 15, 2020
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6RHS
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![BU of 6rhs by Molmil](/molmil-images/mine/6rhs) | Crystal structure of Pediococcus acidilactici (Putative)lactate oxidase Refolded WT protein | 分子名称: | FLAVIN MONONUCLEOTIDE, GLYCEROL, Putative L-lactate oxidase | 著者 | Ashok, Y, Maksimainen, M.M, Kilpelainen, P, Lehtio, L. | 登録日 | 2019-04-22 | 公開日 | 2020-02-12 | 最終更新日 | 2024-01-24 | 実験手法 | X-RAY DIFFRACTION (2.6 Å) | 主引用文献 | FMN-dependent oligomerization of putative lactate oxidase from Pediococcus acidilactici. Plos One, 15, 2020
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6RY4
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![BU of 6ry4 by Molmil](/molmil-images/mine/6ry4) | |
6R9V
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![BU of 6r9v by Molmil](/molmil-images/mine/6r9v) | Crystal structure of Pediococcus acidilactici lactate oxidase A94G mutant | 分子名称: | FLAVIN MONONUCLEOTIDE, GLYCEROL, Putative L-lactate oxidase, ... | 著者 | Ashok, Y, Maksimainen, M.M, Lehtio, L. | 登録日 | 2019-04-04 | 公開日 | 2020-02-12 | 最終更新日 | 2024-01-24 | 実験手法 | X-RAY DIFFRACTION (2 Å) | 主引用文献 | FMN-dependent oligomerization of putative lactate oxidase from Pediococcus acidilactici. Plos One, 15, 2020
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7Z41
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![BU of 7z41 by Molmil](/molmil-images/mine/7z41) | PARP15 catalytic domain in complex with OUL209 | 分子名称: | 5,8-dimethoxy-[1,2,4]triazolo[3,4-b][1,3]benzothiazole, DIMETHYL SULFOXIDE, Protein mono-ADP-ribosyltransferase PARP15 | 著者 | Murthy, S, Maksimainen, M.M, Lehtio, L. | 登録日 | 2022-03-03 | 公開日 | 2023-01-25 | 最終更新日 | 2024-02-07 | 実験手法 | X-RAY DIFFRACTION (2.1 Å) | 主引用文献 | [1,2,4]Triazolo[3,4- b ]benzothiazole Scaffold as Versatile Nicotinamide Mimic Allowing Nanomolar Inhibition of Different PARP Enzymes. J.Med.Chem., 66, 2023
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7R59
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![BU of 7r59 by Molmil](/molmil-images/mine/7r59) | PARP2 catalytic domain in complex with OUL245 | 分子名称: | GLYCEROL, Poly [ADP-ribose] polymerase 2, [1,2,4]triazolo[3,4-b][1,3]benzothiazol-6-ol | 著者 | Galera-Prat, A, Maksimainen, M.M, Lehtio, L. | 登録日 | 2022-02-10 | 公開日 | 2023-01-25 | 最終更新日 | 2024-02-07 | 実験手法 | X-RAY DIFFRACTION (2 Å) | 主引用文献 | [1,2,4]Triazolo[3,4- b ]benzothiazole Scaffold as Versatile Nicotinamide Mimic Allowing Nanomolar Inhibition of Different PARP Enzymes. J.Med.Chem., 66, 2023
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7R3Z
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![BU of 7r3z by Molmil](/molmil-images/mine/7r3z) | Tankyrase 2 catalytic domain in complex with OUL40 | 分子名称: | 6-methyl-[1,2,4]triazolo[3,4-b][1,3]benzothiazole, GLYCEROL, Poly [ADP-ribose] polymerase tankyrase-2, ... | 著者 | Murthy, S, Venkannagari, H, Maksimainen, M.M, Lehtio, L. | 登録日 | 2022-02-08 | 公開日 | 2023-01-25 | 最終更新日 | 2024-02-07 | 実験手法 | X-RAY DIFFRACTION (2.25 Å) | 主引用文献 | [1,2,4]Triazolo[3,4- b ]benzothiazole Scaffold as Versatile Nicotinamide Mimic Allowing Nanomolar Inhibition of Different PARP Enzymes. J.Med.Chem., 66, 2023
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7R4A
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![BU of 7r4a by Molmil](/molmil-images/mine/7r4a) | PARP15 catalytic domain in complex with OUL188 | 分子名称: | 6,8-dimethyl-[1,2,4]triazolo[3,4-b][1,3]benzothiazole, DIMETHYL SULFOXIDE, Protein mono-ADP-ribosyltransferase PARP15 | 著者 | Murthy, S, Maksimainen, M.M, Lehtio, L. | 登録日 | 2022-02-08 | 公開日 | 2023-01-25 | 最終更新日 | 2024-02-07 | 実験手法 | X-RAY DIFFRACTION (1.9 Å) | 主引用文献 | [1,2,4]Triazolo[3,4- b ]benzothiazole Scaffold as Versatile Nicotinamide Mimic Allowing Nanomolar Inhibition of Different PARP Enzymes. J.Med.Chem., 66, 2023
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4IUG
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![BU of 4iug by Molmil](/molmil-images/mine/4iug) | Crystal structure of beta-galactosidase from Aspergillus oryzae in complex with galactose | 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)-beta-D-mannopyranose-(1-3)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-6-O-phosphono-beta-D-mannopyranose-(1-3)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-beta-D-mannopyranose-(1-3)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-beta-D-mannopyranose-(1-4)-beta-D-mannopyranose, ... | 著者 | Maksimainen, M, Rouvinen, J. | 登録日 | 2013-01-21 | 公開日 | 2013-07-31 | 最終更新日 | 2023-09-20 | 実験手法 | X-RAY DIFFRACTION (2.6 Å) | 主引用文献 | The crystal structure of acidic beta-galactosidase from Aspergillus oryzae. Int.J.Biol.Macromol., 60C, 2013
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7OLJ
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![BU of 7olj by Molmil](/molmil-images/mine/7olj) | Tankyrase 2 in complex with an inhibitor (OUL219) | 分子名称: | 8-propan-2-yloxy-4~{H}-thieno[2,3-c]isoquinolin-5-one, GLYCEROL, Poly [ADP-ribose] polymerase tankyrase-2, ... | 著者 | Sowa, S.T, Lehtio, L. | 登録日 | 2021-05-20 | 公開日 | 2021-12-08 | 最終更新日 | 2024-02-07 | 実験手法 | X-RAY DIFFRACTION (1.8 Å) | 主引用文献 | Analogs of TIQ-A as inhibitors of human mono-ADP-ribosylating PARPs. Bioorg.Med.Chem., 52, 2021
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7OMC
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![BU of 7omc by Molmil](/molmil-images/mine/7omc) | Tankyrase 2 in complex with an inhibitor (OUL228) | 分子名称: | 8-propan-2-yloxy-4~{H}-thieno[2,3-c]isoquinolin-5-one, GLYCEROL, Poly [ADP-ribose] polymerase tankyrase-2, ... | 著者 | Sowa, S.T, Lehtio, L. | 登録日 | 2021-05-21 | 公開日 | 2021-12-08 | 最終更新日 | 2024-01-31 | 実験手法 | X-RAY DIFFRACTION (2.1 Å) | 主引用文献 | Analogs of TIQ-A as inhibitors of human mono-ADP-ribosylating PARPs. Bioorg.Med.Chem., 52, 2021
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7OM1
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![BU of 7om1 by Molmil](/molmil-images/mine/7om1) | Tankyrase 2 in complex with an inhibitor (OUL220) | 分子名称: | 8-methoxy-4~{H}-thieno[2,3-c]isoquinolin-5-one, GLYCEROL, Poly [ADP-ribose] polymerase tankyrase-2, ... | 著者 | Sowa, S.T, Lehtio, L. | 登録日 | 2021-05-21 | 公開日 | 2021-12-08 | 最終更新日 | 2024-01-31 | 実験手法 | X-RAY DIFFRACTION (1.7 Å) | 主引用文献 | Analogs of TIQ-A as inhibitors of human mono-ADP-ribosylating PARPs. Bioorg.Med.Chem., 52, 2021
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6HSJ
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![BU of 6hsj by Molmil](/molmil-images/mine/6hsj) | Crystal structure of the zebrafish peroxisomal SCP2-thiolase (type-1) in complex with CoA | 分子名称: | ACETATE ION, COENZYME A, GLYCEROL, ... | 著者 | Wierenga, R.K, Kiema, T.R, Thapa, C.J. | 登録日 | 2018-10-01 | 公開日 | 2019-01-02 | 最終更新日 | 2024-01-24 | 実験手法 | X-RAY DIFFRACTION (1.46 Å) | 主引用文献 | The peroxisomal zebrafish SCP2-thiolase (type-1) is a weak transient dimer as revealed by crystal structures and native mass spectrometry. Biochem. J., 476, 2019
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6HRV
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![BU of 6hrv by Molmil](/molmil-images/mine/6hrv) | |
6HSP
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![BU of 6hsp by Molmil](/molmil-images/mine/6hsp) | Crystal structure of the zebrafish peroxisomal SCP2-thiolase (type-1) in complex with CoA and octanoyl-CoA | 分子名称: | COENZYME A, GLYCEROL, OCTANOYL-COENZYME A, ... | 著者 | Wierenga, R.K, Kiema, T.R, Thapa, C.J. | 登録日 | 2018-10-01 | 公開日 | 2019-01-02 | 最終更新日 | 2024-01-24 | 実験手法 | X-RAY DIFFRACTION (1.73 Å) | 主引用文献 | The peroxisomal zebrafish SCP2-thiolase (type-1) is a weak transient dimer as revealed by crystal structures and native mass spectrometry. Biochem. J., 476, 2019
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