4TVJ
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![BU of 4tvj by Molmil](/molmil-images/mine/4tvj) | HUMAN ARTD2 (PARP2) - CATALYTIC DOMAIN IN COMPLEX WITH OLAPARIB | 分子名称: | 4-(3-{[4-(cyclopropylcarbonyl)piperazin-1-yl]carbonyl}-4-fluorobenzyl)phthalazin-1(2H)-one, GLYCEROL, Poly [ADP-ribose] polymerase 2 | 著者 | Karlberg, T, Thorsell, A.G, Ekblad, T, Pinto, A.F, Schuler, H. | 登録日 | 2014-06-27 | 公開日 | 2015-07-08 | 最終更新日 | 2023-12-20 | 実験手法 | X-RAY DIFFRACTION (2.1 Å) | 主引用文献 | Structural Basis for Potency and Promiscuity in Poly(ADP-ribose) Polymerase (PARP) and Tankyrase Inhibitors. J. Med. Chem., 60, 2017
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4UND
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![BU of 4und by Molmil](/molmil-images/mine/4und) | HUMAN ARTD1 (PARP1) - CATALYTIC DOMAIN IN COMPLEX WITH INHIBITOR TALAZOPARIB | 分子名称: | (8S,9R)-5-fluoro-8-(4-fluorophenyl)-9-(1-methyl-1H-1,2,4-triazol-5-yl)-2,7,8,9-tetrahydro-3H-pyrido[4,3,2-de]phthalazin-3-one, POLY [ADP-RIBOSE] POLYMERASE 1, SODIUM ION | 著者 | Karlberg, T, Thorsell, A.G, Ekblad, T, Klepsch, M, Pinto, A.F, Tresaugues, L, Moche, M, Schuler, H. | 登録日 | 2014-05-27 | 公開日 | 2015-06-17 | 最終更新日 | 2024-01-10 | 実験手法 | X-RAY DIFFRACTION (2.2 Å) | 主引用文献 | Structural Basis for Potency and Promiscuity in Poly(ADP-ribose) Polymerase (PARP) and Tankyrase Inhibitors. J. Med. Chem., 60, 2017
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4BK8
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![BU of 4bk8 by Molmil](/molmil-images/mine/4bk8) | Superoxide reductase (Neelaredoxin) from Ignicoccus hospitalis | 分子名称: | DESULFOFERRODOXIN, FERROUS IRON-BINDING REGION, FE (III) ION | 著者 | Romao, C.V, Matias, P.M, Pinho, F.G, Sousa, C.M, Barradas, A.R, Pinto, A.F, Teixeira, M, Bandeiras, T.M. | 登録日 | 2013-04-22 | 公開日 | 2014-04-02 | 最終更新日 | 2024-05-01 | 実験手法 | X-RAY DIFFRACTION (1.847 Å) | 主引用文献 | Structure of a Natural Sor Mutant To be Published
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4BRV
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![BU of 4brv by Molmil](/molmil-images/mine/4brv) | Superoxide reductase (Neelaredoxin) from Ignicoccus hospitalis E23A | 分子名称: | DESULFOFERRODOXIN, FERROUS IRON-BINDING REGION, FE (III) ION | 著者 | Romao, C.V, Matias, P.M, Pinho, F.G, Sousa, C.M, Barradas, A.R, Pinto, A.F, Teixeira, M, Bandeiras, T.M. | 登録日 | 2013-06-05 | 公開日 | 2014-06-18 | 最終更新日 | 2023-12-20 | 実験手法 | X-RAY DIFFRACTION (2.05 Å) | 主引用文献 | Structure of a Natural Sor Mutant To be Published
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4BFJ
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![BU of 4bfj by Molmil](/molmil-images/mine/4bfj) | Superoxide reductase (Neelaredoxin) from Archaeoglobus fulgidus E12V mutant | 分子名称: | FE (III) ION, SUPEROXIDE REDUCTASE | 著者 | Bandeiras, T.M, Rodrigues, J.V, Sousa, C.M, Barradas, A.R, Pinho, F.G, Pinto, A.F, Teixeira, M, Matias, P.M, Romao, C.V. | 登録日 | 2013-03-19 | 公開日 | 2014-03-26 | 最終更新日 | 2023-12-20 | 実験手法 | X-RAY DIFFRACTION (2.8 Å) | 主引用文献 | Understanding the Role of Key Residues in the Superoxide Reductase Molecular Mechanism, Exploring Archaeoglobus Fulgidus Sor Structure To be Published
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4BFF
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![BU of 4bff by Molmil](/molmil-images/mine/4bff) | Superoxide reductase (Neelaredoxin) from Archaeoglobus fulgidus in the reduced form | 分子名称: | FE (II) ION, SUPEROXIDE REDUCTASE | 著者 | Bandeiras, T.M, Rodrigues, J.V, Sousa, C.M, Barradas, A.R, Pinho, F.G, Pinto, A.F, Teixeira, M, Matias, P.M, Romao, C.V. | 登録日 | 2013-03-18 | 公開日 | 2014-03-26 | 最終更新日 | 2023-12-20 | 実験手法 | X-RAY DIFFRACTION (2 Å) | 主引用文献 | Understanding the Role of Key Residues in the Superoxide Reductase Molecular Mechanism, Exploring Archaeoglobus Fulgidus Sor Structure To be Published
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4BRJ
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![BU of 4brj by Molmil](/molmil-images/mine/4brj) | Superoxide reductase (Neelaredoxin) from Ignicoccus hospitalis T24K | 分子名称: | DESULFOFERRODOXIN, FERROUS IRON-BINDING REGION, FE (III) ION | 著者 | Romao, C.V, Matias, P.M, Pinho, F.G, Sousa, C.M, Barradas, A.R, Pinto, A.F, Teixeira, M, Bandeiras, T.M. | 登録日 | 2013-06-04 | 公開日 | 2014-06-11 | 最終更新日 | 2023-12-20 | 実験手法 | X-RAY DIFFRACTION (2.5 Å) | 主引用文献 | Structure of a Natural Sor Mutant To be Published
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4C4U
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![BU of 4c4u by Molmil](/molmil-images/mine/4c4u) | Superoxide reductase (Neelaredoxin) from Archaeoglobus fulgidus E12Q mutant in the reduced form | 分子名称: | FE (II) ION, SUPEROXIDE REDUCTASE | 著者 | Bandeiras, T.M, Rodrigues, J.V, Sousa, C.M, Barradas, A.R, Pinho, F.G, Pinto, A.F, Teixeira, M, Matias, P.M, Romao, C.V. | 登録日 | 2013-09-09 | 公開日 | 2014-08-06 | 最終更新日 | 2023-12-20 | 実験手法 | X-RAY DIFFRACTION (2.583 Å) | 主引用文献 | Understanding the Role of Key Residues in the Superoxide Reductase Molecular Mechanism, Exploring Archaeoglobus Fulgidus Sor Structure To be Published
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4C4B
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![BU of 4c4b by Molmil](/molmil-images/mine/4c4b) | Superoxide reductase (Neelaredoxin) from Archaeoglobus fulgidus E12V in the reduced form | 分子名称: | 1,2-ETHANEDIOL, FE (II) ION, SUPEROXIDE REDUCTASE | 著者 | Bandeiras, T.M, Rodrigues, J.V, Sousa, C.M, Barradas, A.R, Pinho, F.G, Pinto, A.F, Teixeira, M, Matias, P.M, Romao, C.V. | 登録日 | 2013-09-03 | 公開日 | 2014-07-23 | 最終更新日 | 2023-12-20 | 実験手法 | X-RAY DIFFRACTION (2.5 Å) | 主引用文献 | Understanding the Role of Key Residues in the Superoxide Reductase Molecular Mechanism, Exploring Archaeoglobus Fulgidus Sor Structure To be Published
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4BFK
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![BU of 4bfk by Molmil](/molmil-images/mine/4bfk) | Superoxide reductase (Neelaredoxin) from Archaeoglobus fulgidus E12Q mutant | 分子名称: | FE (III) ION, SUPEROXIDE REDUCTASE | 著者 | Bandeiras, T.M, Rodrigues, J.V, Sousa, C.M, Barradas, A.R, Pinho, F.G, Pinto, A.F, Teixeira, M, Matias, P.M, Romao, C.V. | 登録日 | 2013-03-19 | 公開日 | 2014-03-26 | 最終更新日 | 2023-12-20 | 実験手法 | X-RAY DIFFRACTION (2.103 Å) | 主引用文献 | Understanding the Role of Key Residues in the Superoxide Reductase Molecular Mechanism, Exploring Archaeoglobus Fulgidus Sor Structure To be Published
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4BGL
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![BU of 4bgl by Molmil](/molmil-images/mine/4bgl) | Superoxide reductase (Neelaredoxin) from Archaeoglobus fulgidus | 分子名称: | FE (III) ION, GLYCEROL, SUPEROXIDE REDUCTASE | 著者 | Bandeiras, T.M, Rodrigues, J.V, Sousa, C.M, Barradas, A.R, Pinho, F.G, Pinto, A.F, Teixeira, M, Matias, P.M, Romao, C.V. | 登録日 | 2013-03-27 | 公開日 | 2014-04-09 | 最終更新日 | 2024-05-08 | 実験手法 | X-RAY DIFFRACTION (1.9 Å) | 主引用文献 | Superoxide Reductase from Giardia Intestinalis: Structural Characterization of the First Sor from a Eukaryotic Organism Shows an Iron Centre that is Highly Sensitive to Photoreduction Acta Crystallogr.,Sect.D, 71, 2015
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6GNK
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![BU of 6gnk by Molmil](/molmil-images/mine/6gnk) | Exoenzyme S from Pseudomonas aeruginosa in complex with human 14-3-3 protein beta, trimeric crystal form bound to Carba-NAD | 分子名称: | (4S)-2-METHYL-2,4-PENTANEDIOL, 14-3-3 protein beta/alpha, CARBA-NICOTINAMIDE-ADENINE-DINUCLEOTIDE, ... | 著者 | Karlberg, T, Pinto, A.F, Hornyak, P, Thorsell, A.G, Nareoja, K, Schuler, H. | 登録日 | 2018-05-31 | 公開日 | 2018-09-26 | 最終更新日 | 2024-01-17 | 実験手法 | X-RAY DIFFRACTION (2.55 Å) | 主引用文献 | 14-3-3 proteins activate Pseudomonas exotoxins-S and -T by chaperoning a hydrophobic surface. Nat Commun, 9, 2018
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6GNJ
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![BU of 6gnj by Molmil](/molmil-images/mine/6gnj) | Exoenzyme S from Pseudomonas aeruginosa in complex with human 14-3-3 protein beta, trimeric crystal form in complex with STO1101 | 分子名称: | 14-3-3 protein beta/alpha, 3-(12-oxidanylidene-7-thia-9,11-diazatricyclo[6.4.0.0^{2,6}]dodeca-1(8),2(6),9-trien-10-yl)propanoic acid, Exoenzyme S | 著者 | Karlberg, T, Pinto, A.F, Hornyak, P, Thorsell, A.G, Nareoja, K, Schuler, H. | 登録日 | 2018-05-31 | 公開日 | 2018-09-26 | 最終更新日 | 2024-01-17 | 実験手法 | X-RAY DIFFRACTION (3.24 Å) | 主引用文献 | 14-3-3 proteins activate Pseudomonas exotoxins-S and -T by chaperoning a hydrophobic surface. Nat Commun, 9, 2018
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6GN0
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![BU of 6gn0 by Molmil](/molmil-images/mine/6gn0) | Exoenzyme S from Pseudomonas aeruginosa in complex with human 14-3-3 protein beta, tetrameric crystal form | 分子名称: | 14-3-3 protein beta/alpha, Exoenzyme S | 著者 | Karlberg, T, Pinto, A.F, Hornyak, P, Nareoja, K, Schuler, H. | 登録日 | 2018-05-29 | 公開日 | 2018-09-26 | 最終更新日 | 2024-01-17 | 実験手法 | X-RAY DIFFRACTION (3.24 Å) | 主引用文献 | 14-3-3 proteins activate Pseudomonas exotoxins-S and -T by chaperoning a hydrophobic surface. Nat Commun, 9, 2018
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6GNN
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![BU of 6gnn by Molmil](/molmil-images/mine/6gnn) | Exoenzyme T from Pseudomonas aeruginosa in complex with human 14-3-3 protein beta, tetrameric crystal form bound to STO1101 | 分子名称: | 14-3-3 protein beta/alpha, 3-(12-oxidanylidene-7-thia-9,11-diazatricyclo[6.4.0.0^{2,6}]dodeca-1(8),2(6),9-trien-10-yl)propanoic acid, Exoenzyme T | 著者 | Karlberg, T, Pinto, A.F, Hornyak, P, Thorsell, A.G, Nareoja, K, Schuler, H. | 登録日 | 2018-05-31 | 公開日 | 2018-09-26 | 最終更新日 | 2024-01-17 | 実験手法 | X-RAY DIFFRACTION (3.79 Å) | 主引用文献 | 14-3-3 proteins activate Pseudomonas exotoxins-S and -T by chaperoning a hydrophobic surface. Nat Commun, 9, 2018
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6GN8
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![BU of 6gn8 by Molmil](/molmil-images/mine/6gn8) | Exoenzyme S from Pseudomonas aeruginosa in complex with human 14-3-3 protein beta, trimeric crystal form | 分子名称: | (4S)-2-METHYL-2,4-PENTANEDIOL, 14-3-3 protein beta/alpha, Exoenzyme S | 著者 | Karlberg, T, Pinto, A.F, Hornyak, P, Thorsell, A.G, Nareoja, K, Schuler, H. | 登録日 | 2018-05-30 | 公開日 | 2018-09-26 | 最終更新日 | 2024-01-17 | 実験手法 | X-RAY DIFFRACTION (2.34 Å) | 主引用文献 | 14-3-3 proteins activate Pseudomonas exotoxins-S and -T by chaperoning a hydrophobic surface. Nat Commun, 9, 2018
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6HXS
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![BU of 6hxs by Molmil](/molmil-images/mine/6hxs) | Human PARP16 (ARTD15) IN COMPLEX WITH CARBA-NAD | 分子名称: | ADENOSINE, CARBA-NICOTINAMIDE-ADENINE-DINUCLEOTIDE, GLYCEROL, ... | 著者 | Karlberg, T, Pinto, A.F, Thorsell, A.G, Schuler, H. | 登録日 | 2018-10-18 | 公開日 | 2019-10-30 | 最終更新日 | 2024-01-24 | 実験手法 | X-RAY DIFFRACTION (2.05 Å) | 主引用文献 | Human PARP16 (ARTD15) IN COMPLEX WITH CARBA-NAD To Be Published
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6HXR
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![BU of 6hxr by Molmil](/molmil-images/mine/6hxr) | Human PARP16 (ARTD15) IN COMPLEX WITH EB-47 | 分子名称: | 2-[4-[(2S,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]carbonylpiperazin-1-yl]-N-(1-oxidanylidene-2,3-dihydroisoindol-4-yl)ethanamide, Mono [ADP-ribose] polymerase PARP16 | 著者 | Karlberg, T, Pinto, A.F, Thorsell, A.G, Schuler, H. | 登録日 | 2018-10-18 | 公開日 | 2019-10-30 | 最終更新日 | 2024-01-31 | 実験手法 | X-RAY DIFFRACTION (2.9 Å) | 主引用文献 | Human PARP16 (ARTD15) IN COMPLEX WITH EB-47 To Be Published
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5TSQ
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![BU of 5tsq by Molmil](/molmil-images/mine/5tsq) | Crystal structure of IUnH from Leishmania braziliensis in complex with D-Ribose | 分子名称: | CALCIUM ION, IUnH, beta-D-ribofuranose | 著者 | Bachega, J.F.R, Timmers, L.F.S.M, Dalberto, P.F, Martinelli, L, Pinto, A.F.M, Basso, L.A, Norberto de Souza, O, Santos, D.S. | 登録日 | 2016-10-31 | 公開日 | 2016-12-14 | 最終更新日 | 2023-10-04 | 実験手法 | X-RAY DIFFRACTION (1.53 Å) | 主引用文献 | Crystal structure of IUnH from Leishmania braziliensis in complex with D-Ribose To Be Published
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4R6E
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![BU of 4r6e by Molmil](/molmil-images/mine/4r6e) | Human artd1 (parp1) - catalytic domain in complex with inhibitor niraparib | 分子名称: | 2-{4-[(3S)-piperidin-3-yl]phenyl}-2H-indazole-7-carboxamide, GLYCEROL, Poly [ADP-ribose] polymerase 1, ... | 著者 | Karlberg, T, Thorsell, A.G, Brock, J, Schuler, H. | 登録日 | 2014-08-25 | 公開日 | 2015-09-09 | 最終更新日 | 2023-09-20 | 実験手法 | X-RAY DIFFRACTION (2.2 Å) | 主引用文献 | Structural Basis for Potency and Promiscuity in Poly(ADP-ribose) Polymerase (PARP) and Tankyrase Inhibitors. J.Med.Chem., 60, 2017
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4UXB
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![BU of 4uxb by Molmil](/molmil-images/mine/4uxb) | Human ARTD1 (PARP1) - Catalytic domain in complex with inhibitor PJ34 | 分子名称: | N~2~,N~2~-DIMETHYL-N~1~-(6-OXO-5,6-DIHYDROPHENANTHRIDIN-2-YL)GLYCINAMIDE, POLY ADP-RIBOSE POLYMERASE 1, SULFATE ION | 著者 | Tresaugues, L, Thorsell, A.G, Karlberg, T, Schuler, H. | 登録日 | 2014-08-21 | 公開日 | 2015-09-02 | 最終更新日 | 2024-01-10 | 実験手法 | X-RAY DIFFRACTION (3.22 Å) | 主引用文献 | Structural Basis for Potency and Promiscuity in Poly(ADP-ribose) Polymerase (PARP) and Tankyrase Inhibitors. J. Med. Chem., 60, 2017
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5LX6
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![BU of 5lx6 by Molmil](/molmil-images/mine/5lx6) | |
4RV6
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![BU of 4rv6 by Molmil](/molmil-images/mine/4rv6) | |
4GV0
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![BU of 4gv0 by Molmil](/molmil-images/mine/4gv0) | Human ARTD3 (PARP3) - Catalytic domain in complex with inhibitor ME0355 | 分子名称: | 3-(4-oxo-3,4-dihydroquinazolin-2-yl)-N-[(1S)-1-(pyridin-2-yl)ethyl]propanamide, DIMETHYL SULFOXIDE, Poly [ADP-ribose] polymerase 3 | 著者 | Karlberg, T, Thorsell, A.G, Lindgren, A.E.G, Ekblad, T, Spjut, S, Andersson, C.D, Weigelt, J, Linusson, A, Elofsson, M, Schuler, H. | 登録日 | 2012-08-30 | 公開日 | 2013-06-19 | 最終更新日 | 2023-11-08 | 実験手法 | X-RAY DIFFRACTION (1.9 Å) | 主引用文献 | PARP Inhibitor with Selectivity Toward ADP-Ribosyltransferase ARTD3/PARP3 Acs Chem.Biol., 8, 2013
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4GV4
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![BU of 4gv4 by Molmil](/molmil-images/mine/4gv4) | Human ARTD3 (PARP3) - Catalytic domain in complex with inhibitor ME0328 | 分子名称: | 3-(4-oxo-3,4-dihydroquinazolin-2-yl)-N-[(1S)-1-phenylethyl]propanamide, DIMETHYL SULFOXIDE, Poly [ADP-ribose] polymerase 3 | 著者 | Karlberg, T, Thorsell, A.G, Lindgren, A.E.G, Ekblad, T, Spjut, S, Andersson, C.D, Weigelt, J, Linusson, A, Elofsson, M, Schuler, H. | 登録日 | 2012-08-30 | 公開日 | 2013-06-19 | 最終更新日 | 2023-11-08 | 実験手法 | X-RAY DIFFRACTION (1.8 Å) | 主引用文献 | PARP Inhibitor with Selectivity Toward ADP-Ribosyltransferase ARTD3/PARP3 Acs Chem.Biol., 8, 2013
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