3WGX
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![BU of 3wgx by Molmil](/molmil-images/mine/3wgx) | Crystal structure of ERp46 Trx2 in a complex with Prx4 C-term | 分子名称: | GLYCEROL, Peroxiredoxin-4, Thioredoxin domain-containing protein 5 | 著者 | Inaba, K, Suzuki, M, Kojima, R. | 登録日 | 2013-08-13 | 公開日 | 2014-06-25 | 実験手法 | X-RAY DIFFRACTION (0.92 Å) | 主引用文献 | Radically different thioredoxin domain arrangement of ERp46, an efficient disulfide bond introducer of the mammalian PDI family Structure, 22, 2014
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2FVY
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![BU of 2fvy by Molmil](/molmil-images/mine/2fvy) | High Resolution Glucose Bound Crystal Structure of GGBP | 分子名称: | ACETATE ION, CALCIUM ION, CARBON DIOXIDE, ... | 著者 | Borrok, M.J, Kiessling, L.L, Forest, K.T. | 登録日 | 2006-01-31 | 公開日 | 2007-02-06 | 最終更新日 | 2024-04-03 | 実験手法 | X-RAY DIFFRACTION (0.92 Å) | 主引用文献 | Conformational changes of glucose/galactose-binding protein illuminated by open, unliganded, and ultra-high-resolution ligand-bound structures. Protein Sci., 16, 2007
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2G6F
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6TJ8
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![BU of 6tj8 by Molmil](/molmil-images/mine/6tj8) | Escherichia coli transketolase in complex with cofactor analog 2'-methoxythiamine diphosphate | 分子名称: | 1,2-ETHANEDIOL, 2-[3-[(4-azanyl-2-methoxy-pyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-5-yl]ethyl phosphono hydrogen phosphate, CALCIUM ION, ... | 著者 | Rabe von Pappenheim, F, Tittmann, K. | 登録日 | 2019-11-25 | 公開日 | 2020-07-08 | 最終更新日 | 2024-01-24 | 実験手法 | X-RAY DIFFRACTION (0.921 Å) | 主引用文献 | Structural basis for antibiotic action of the B 1 antivitamin 2'-methoxy-thiamine. Nat.Chem.Biol., 16, 2020
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6TE2
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![BU of 6te2 by Molmil](/molmil-images/mine/6te2) | Crystal structure of human protein kinase CK2alpha' (CSNK2A2 gene product) in complex with the 2-aminothiazole-type inhibitor 17 | 分子名称: | 3-[(4-pyridin-2-yl-1,3-thiazol-2-yl)amino]benzoic acid, Casein kinase II subunit alpha' | 著者 | Niefind, K, Lindenblatt, D, Jose, J, Applegate, V.M, Nickelsen, A. | 登録日 | 2019-11-11 | 公開日 | 2020-07-08 | 最終更新日 | 2024-05-15 | 実験手法 | X-RAY DIFFRACTION (0.922 Å) | 主引用文献 | Structural and Mechanistic Basis of the Inhibitory Potency of Selected 2-Aminothiazole Compounds on Protein Kinase CK2. J.Med.Chem., 63, 2020
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6UMY
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7MBO
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![BU of 7mbo by Molmil](/molmil-images/mine/7mbo) | FACTOR XIA (PICHIA PASTORIS; C500S [C122S]) IN COMPLEX WITH THE INHIBITOR Milvexian (BMS-986177), IUPAC NAME:(6R,10S)-10-{4-[5-chloro-2-(4-chloro-1H-1,2,3-triazol-1-yl)phenyl]-6- oxopyrimidin-1(6H)-yl}-1-(difluoromethyl)-6-methyl-1,4,7,8,9,10-hexahydro-15,11- (metheno)pyrazolo[4,3-b][1,7]diazacyclotetradecin-5(6H)-one | 分子名称: | 2-acetamido-2-deoxy-beta-D-glucopyranose, Coagulation factor XIa light chain, Milvexian | 著者 | Sheriff, S. | 登録日 | 2021-04-01 | 公開日 | 2021-09-15 | 最終更新日 | 2023-10-18 | 実験手法 | X-RAY DIFFRACTION (0.924 Å) | 主引用文献 | Discovery of Milvexian, a High-Affinity, Orally Bioavailable Inhibitor of Factor XIa in Clinical Studies for Antithrombotic Therapy. J.Med.Chem., 65, 2022
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3LZT
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![BU of 3lzt by Molmil](/molmil-images/mine/3lzt) | REFINEMENT OF TRICLINIC LYSOZYME AT ATOMIC RESOLUTION | 分子名称: | ACETATE ION, LYSOZYME, NITRATE ION | 著者 | Walsh, M.A, Schneider, T, Sieker, L.C, Dauter, Z, Lamzin, V, Wilson, K.S. | 登録日 | 1997-03-23 | 公開日 | 1998-03-25 | 最終更新日 | 2023-08-09 | 実験手法 | X-RAY DIFFRACTION (0.925 Å) | 主引用文献 | Refinement of triclinic hen egg-white lysozyme at atomic resolution. Acta Crystallogr.,Sect.D, 54, 1998
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6ZSY
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6ROB
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![BU of 6rob by Molmil](/molmil-images/mine/6rob) | Human Carbonic Anhydrase II in complex with 4-cyanobenzenesulfonamide | 分子名称: | (4-CARBOXYPHENYL)(CHLORO)MERCURY, 4-cyanobenzenesulfonamide, Carbonic anhydrase 2, ... | 著者 | Gloeckner, S, Heine, A, Klebe, G. | 登録日 | 2019-05-10 | 公開日 | 2020-04-15 | 最終更新日 | 2024-01-24 | 実験手法 | X-RAY DIFFRACTION (0.929 Å) | 主引用文献 | The Influence of Varying Fluorination Patterns on the Thermodynamics and Kinetics of Benzenesulfonamide Binding to Human Carbonic Anhydrase II. Biomolecules, 10, 2020
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3QL9
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6KM0
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3M5Q
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![BU of 3m5q by Molmil](/molmil-images/mine/3m5q) | 0.93 A Structure of Manganese-Bound Manganese Peroxidase | 分子名称: | 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, CALCIUM ION, GLYCEROL, ... | 著者 | Sundaramoorthy, M, Gold, M.H, Poulos, T.L. | 登録日 | 2010-03-12 | 公開日 | 2010-04-14 | 最終更新日 | 2023-09-06 | 実験手法 | X-RAY DIFFRACTION (0.93 Å) | 主引用文献 | Ultrahigh (0.93A) resolution structure of manganese peroxidase from Phanerochaete chrysosporium: implications for the catalytic mechanism. J.Inorg.Biochem., 104, 2010
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5X9M
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![BU of 5x9m by Molmil](/molmil-images/mine/5x9m) | Structure of hyper-sweet thaumatin (D21N) | 分子名称: | GLYCEROL, L(+)-TARTARIC ACID, Thaumatin I | 著者 | Masuda, T, Okubo, K, Sugahara, M, Suzuki, M, Mikami, B. | 登録日 | 2017-03-08 | 公開日 | 2018-03-14 | 最終更新日 | 2023-11-22 | 実験手法 | X-RAY DIFFRACTION (0.93 Å) | 主引用文献 | Subatomic structure of hyper-sweet thaumatin D21N mutant reveals the importance of flexible conformations for enhanced sweetness. Biochimie, 157, 2019
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8PB6
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![BU of 8pb6 by Molmil](/molmil-images/mine/8pb6) | PsiM in complex with SAH and baeocystin | 分子名称: | Baeocystin, CHLORIDE ION, Psilocybin synthase, ... | 著者 | Werten, S, Hudspeth, J, Rupp, B. | 登録日 | 2023-06-08 | 公開日 | 2024-04-03 | 最終更新日 | 2024-04-10 | 実験手法 | X-RAY DIFFRACTION (0.93 Å) | 主引用文献 | Methyl transfer in psilocybin biosynthesis. Nat Commun, 15, 2024
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5MNH
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![BU of 5mnh by Molmil](/molmil-images/mine/5mnh) | Cationic trypsin in complex with benzamidine (deuterated sample at 295 K) | 分子名称: | BENZAMIDINE, CALCIUM ION, Cationic trypsin, ... | 著者 | Schiebel, J, Heine, A, Klebe, G. | 登録日 | 2016-12-13 | 公開日 | 2018-01-17 | 最終更新日 | 2024-01-17 | 実験手法 | X-RAY DIFFRACTION (0.93 Å) | 主引用文献 | Intriguing role of water in protein-ligand binding studied by neutron crystallography on trypsin complexes. Nat Commun, 9, 2018
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5MOQ
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![BU of 5moq by Molmil](/molmil-images/mine/5moq) | Joint X-ray/neutron structure of cationic trypsin in complex with benzamidine | 分子名称: | BENZAMIDINE, CALCIUM ION, Cationic trypsin, ... | 著者 | Schiebel, J, Schrader, T.E, Ostermann, A, Heine, A, Klebe, G. | 登録日 | 2016-12-14 | 公開日 | 2018-02-28 | 最終更新日 | 2024-05-01 | 実験手法 | NEUTRON DIFFRACTION (0.93 Å), X-RAY DIFFRACTION | 主引用文献 | Intriguing role of water in protein-ligand binding studied by neutron crystallography on trypsin complexes. Nat Commun, 9, 2018
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7VDN
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![BU of 7vdn by Molmil](/molmil-images/mine/7vdn) | High resolution crystal structure of Sperm Whale Myoglobin in the carbonmonoxy form | 分子名称: | CARBON MONOXIDE, Myoglobin, PROTOPORPHYRIN IX CONTAINING FE, ... | 著者 | Shibayama, N, Sato-Tomita, A, Ishimoto, N, Park, S.Y. | 登録日 | 2021-09-07 | 公開日 | 2022-09-14 | 最終更新日 | 2023-11-29 | 実験手法 | X-RAY DIFFRACTION (0.93 Å) | 主引用文献 | X-ray fluorescence holography of biological metal sites: Application to myoglobin. Biochem.Biophys.Res.Commun., 635, 2022
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7KQW
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![BU of 7kqw by Molmil](/molmil-images/mine/7kqw) | Crystal structure of SARS-CoV-2 NSP3 macrodomain (C2 crystal form, methylated) | 分子名称: | Non-structural protein 3 | 著者 | Correy, G.J, Young, I.D, Thompson, M.C, Fraser, J.S. | 登録日 | 2020-11-17 | 公開日 | 2020-12-09 | 最終更新日 | 2023-11-15 | 実験手法 | X-RAY DIFFRACTION (0.93 Å) | 主引用文献 | Fragment binding to the Nsp3 macrodomain of SARS-CoV-2 identified through crystallographic screening and computational docking. Sci Adv, 7, 2021
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1OK0
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![BU of 1ok0 by Molmil](/molmil-images/mine/1ok0) | Crystal Structure of Tendamistat | 分子名称: | ALPHA-AMYLASE INHIBITOR HOE-467A, CHLORIDE ION, GLYCEROL | 著者 | Koenig, V, Vertesy, L, Schneider, T.R. | 登録日 | 2003-07-16 | 公開日 | 2004-01-15 | 最終更新日 | 2023-12-13 | 実験手法 | X-RAY DIFFRACTION (0.93 Å) | 主引用文献 | Crystal Structure of the Alpha-Amylase Inhibitor Tendamistat at 0.93 A Acta Crystallogr.,Sect.D, 59, 2003
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8UVZ
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8UW0
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8A4N
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5QU8
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3FX5
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![BU of 3fx5 by Molmil](/molmil-images/mine/3fx5) | Structure of HIV-1 Protease in Complex with Potent Inhibitor KNI-272 Determined by High Resolution X-ray Crystallography | 分子名称: | (4R)-N-tert-butyl-3-[(2S,3S)-2-hydroxy-3-({N-[(isoquinolin-5-yloxy)acetyl]-S-methyl-L-cysteinyl}amino)-4-phenylbutanoyl]-1,3-thiazolidine-4-carboxamide, GLYCEROL, protease | 著者 | Adachi, M, Ohhara, T, Tamada, T, Okazaki, N, Kuroki, R. | 登録日 | 2009-01-20 | 公開日 | 2009-03-24 | 最終更新日 | 2023-11-01 | 実験手法 | X-RAY DIFFRACTION (0.93 Å) | 主引用文献 | Structure of HIV-1 protease in complex with potent inhibitor KNI-272 determined by high-resolution X-ray and neutron crystallography. Proc.Natl.Acad.Sci.USA, 2009
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