7TLL
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![BU of 7tll by Molmil](/molmil-images/mine/7tll) | Structure of SARS-CoV-2 Mpro Omicron P132H in complex with Nirmatrelvir (PF-07321332) | 分子名称: | (1R,2S,5S)-N-{(1E,2S)-1-imino-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl}-6,6-dimethyl-3-[3-methyl-N-(trifluoroacetyl)-L-valyl]-3-azabicyclo[3.1.0]hexane-2-carboxamide, 3C-like proteinase nsp5 | 著者 | Greasley, S.E, Ferre, R.A, Plotnikova, O, Liu, W, Stewart, A.E. | 登録日 | 2022-01-18 | 公開日 | 2022-01-26 | 最終更新日 | 2022-06-15 | 実験手法 | X-RAY DIFFRACTION (1.63 Å) | 主引用文献 | Structural basis for the in vitro efficacy of nirmatrelvir against SARS-CoV-2 variants. J.Biol.Chem., 298, 2022
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3KUK
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![BU of 3kuk by Molmil](/molmil-images/mine/3kuk) | Trapping of an oxocarbenium ion intermediate in UP crystals | 分子名称: | 2'-DEOXYURIDINE, SULFATE ION, Uridine phosphorylase | 著者 | Paul, D, O'Leary, S, Rajashankar, K, Bu, W, Toms, A, Settembre, E, Sanders, J, Begley, T.P, Ealick, S.E. | 登録日 | 2009-11-27 | 公開日 | 2010-04-28 | 最終更新日 | 2024-02-21 | 実験手法 | X-RAY DIFFRACTION (2.783 Å) | 主引用文献 | Glycal formation in crystals of uridine phosphorylase. Biochemistry, 49, 2010
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1LZZ
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![BU of 1lzz by Molmil](/molmil-images/mine/1lzz) | Rat neuronal NOS heme domain with N-isopropyl-N'-hydroxyguanidine bound | 分子名称: | 5,6,7,8-TETRAHYDROBIOPTERIN, ACETATE ION, N-ISOPROPYL-N'-HYDROXYGUANIDINE, ... | 著者 | Li, H, Shimizu, H, Flinspach, M, Jamal, J, Yang, W, Xian, M, Cai, T, Wen, E.Z, Jia, Q, Wang, P.G, Poulos, T.L. | 登録日 | 2002-06-11 | 公開日 | 2002-11-27 | 最終更新日 | 2024-02-14 | 実験手法 | X-RAY DIFFRACTION (2.05 Å) | 主引用文献 | The Novel Binding Mode of N-Alkyl-N'-Hydroxyguanidine to Neuronal Nitric Oxide
Synthase Provides Mechanistic Insights into NO Biosynthesis Biochemistry, 41, 2002
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1M0P
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![BU of 1m0p by Molmil](/molmil-images/mine/1m0p) | Structure of Dialkylglycine Decarboxylase Complexed with 1-Amino-1-phenylethanephosphonate | 分子名称: | (1R)-1-[((1E)-{3-HYDROXY-2-METHYL-5-[(PHOSPHONOOXY)METHYL]PYRIDIN-4-YL}METHYLENE)AMINO]-1-PHENYLETHYLPHOSPHONIC ACID, 2,2-Dialkylglycine Decarboxylase, POTASSIUM ION, ... | 著者 | Liu, W, Rogers, C.J, Fisher, A.J, Toney, M.D. | 登録日 | 2002-06-13 | 公開日 | 2002-10-23 | 最終更新日 | 2024-02-14 | 実験手法 | X-RAY DIFFRACTION (2.6 Å) | 主引用文献 | Aminophosphonate Inhibitors of Dialkylglycine Decarboxylase: Structural Basis for Slow Binding Inhibition Biochemistry, 41, 2002
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3KVY
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![BU of 3kvy by Molmil](/molmil-images/mine/3kvy) | Trapping of an oxocarbenium ion intermediate in UP crystals | 分子名称: | 1,4-anhydro-D-erythro-pent-1-enitol, SULFATE ION, URACIL, ... | 著者 | Paul, D, O'Leary, S, Rajashankar, K, Bu, W, Toms, A, Settembre, E, Sanders, J, Begley, T.P, Ealick, S.E. | 登録日 | 2009-11-30 | 公開日 | 2010-04-28 | 最終更新日 | 2024-02-21 | 実験手法 | X-RAY DIFFRACTION (2.3 Å) | 主引用文献 | Glycal formation in crystals of uridine phosphorylase. Biochemistry, 49, 2010
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1M60
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![BU of 1m60 by Molmil](/molmil-images/mine/1m60) | Solution Structure of Zinc-substituted cytochrome c | 分子名称: | ZINC SUBSTITUTED HEME C, Zinc-substituted cytochrome c | 著者 | Qian, C, Yao, Y, Tong, Y, Wang, J, Tang, W. | 登録日 | 2002-07-11 | 公開日 | 2002-08-07 | 最終更新日 | 2022-02-23 | 実験手法 | SOLUTION NMR | 主引用文献 | Structural analysis of zinc-substituted cytochrome c. J.Biol.Inorg.Chem., 8, 2003
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1M6T
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![BU of 1m6t by Molmil](/molmil-images/mine/1m6t) | CRYSTAL STRUCTURE OF B562RIL, A REDESIGNED FOUR HELIX BUNDLE | 分子名称: | SULFATE ION, Soluble cytochrome b562 | 著者 | Chu, R, Takei, J, Knowlton, J.R, Andrykovitch, M, Pei, W, Kajava, A.V, Steinbach, P.J, Ji, X, Bai, Y. | 登録日 | 2002-07-17 | 公開日 | 2002-11-06 | 最終更新日 | 2023-08-30 | 実験手法 | X-RAY DIFFRACTION (1.81 Å) | 主引用文献 | Redesign of a Four-Helix Bundle Protein by Phage Display Coupled with Proteolysis
and Structural Characterization by NMR and X-ray Crystallography J.Mol.Biol., 323, 2002
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3NOJ
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![BU of 3noj by Molmil](/molmil-images/mine/3noj) | The structure of HMG/CHA aldolase from the protocatechuate degradation pathway of Pseudomonas putida | 分子名称: | 4-carboxy-4-hydroxy-2-oxoadipate aldolase/oxaloacetate decarboxylase, MAGNESIUM ION, PYRUVIC ACID, ... | 著者 | Kimber, M.S, Wang, W, Mazurkewich, S, Seah, S.Y.K. | 登録日 | 2010-06-25 | 公開日 | 2010-09-15 | 最終更新日 | 2023-11-15 | 実験手法 | X-RAY DIFFRACTION (1.82 Å) | 主引用文献 | Structural and Kinetic Characterization of 4-Hydroxy-4-methyl-2-oxoglutarate/4-Carboxy-4-hydroxy-2-oxoadipate Aldolase, a Protocatechuate Degradation Enzyme Evolutionarily Convergent with the HpaI and DmpG Pyruvate Aldolases. J.Biol.Chem., 285, 2010
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1LUJ
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![BU of 1luj by Molmil](/molmil-images/mine/1luj) | Crystal Structure of the Beta-catenin/ICAT Complex | 分子名称: | Beta-catenin-interacting protein 1, Catenin beta-1 | 著者 | Graham, T.A, Clements, W.K, Kimelman, D, Xu, W. | 登録日 | 2002-05-22 | 公開日 | 2002-10-16 | 最終更新日 | 2024-02-14 | 実験手法 | X-RAY DIFFRACTION (2.5 Å) | 主引用文献 | The crystal structure of the beta-catenin/ICAT complex reveals the inhibitory mechanism of ICAT. Mol.Cell, 10, 2002
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1C0L
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![BU of 1c0l by Molmil](/molmil-images/mine/1c0l) | D-AMINO ACID OXIDASE: STRUCTURE OF SUBSTRATE COMPLEXES AT VERY HIGH RESOLUTION REVEAL THE CHEMICAL REACTTION MECHANISM OF FLAVIN DEHYDROGENATION | 分子名称: | D-AMINO ACID OXIDASE, FLAVIN-ADENINE DINUCLEOTIDE, TRIFLUOROALANINE | 著者 | Umhau, S, Molla, G, Diederichs, K, Pilone, M.S, Ghisla, S, Welte, W. | 登録日 | 1999-07-16 | 公開日 | 2000-11-22 | 最終更新日 | 2024-02-07 | 実験手法 | X-RAY DIFFRACTION (1.73 Å) | 主引用文献 | The x-ray structure of D-amino acid oxidase at very high resolution identifies the chemical mechanism of flavin-dependent substrate dehydrogenation. Proc.Natl.Acad.Sci.USA, 97, 2000
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5F8P
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![BU of 5f8p by Molmil](/molmil-images/mine/5f8p) | A Novel Inhibitor of the Obesity-Related Protein FTO | 分子名称: | 2-OXOGLUTARIC ACID, 4-chloranyl-6-[(2~{S})-6-chloranyl-2,4,4-trimethyl-7-oxidanyl-3~{H}-chromen-2-yl]benzene-1,3-diol, Alpha-ketoglutarate-dependent dioxygenase FTO, ... | 著者 | Chai, J, Zhou, B, Liu, W, Han, Z. | 登録日 | 2015-12-09 | 公開日 | 2016-12-14 | 実験手法 | X-RAY DIFFRACTION (2.2 Å) | 主引用文献 | Crystal structure of FTO-CHTB To Be Published
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5FKN
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![BU of 5fkn by Molmil](/molmil-images/mine/5fkn) | TetR(D) T103A mutant in complex with anhydrotetracycline and magnesium, P4(3)2(1)2 | 分子名称: | 5A,6-ANHYDROTETRACYCLINE, CHLORIDE ION, MAGNESIUM ION, ... | 著者 | Werten, S, Schneider, J, Palm, G.J, Hinrichs, W. | 登録日 | 2015-10-17 | 公開日 | 2016-04-06 | 最終更新日 | 2024-01-10 | 実験手法 | X-RAY DIFFRACTION (1.8 Å) | 主引用文献 | Modular Organisation of Inducer Recognition and Allostery in the Tetracycline Repressor FEBS J., 283, 2016
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1IBQ
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![BU of 1ibq by Molmil](/molmil-images/mine/1ibq) | ASPERGILLOPEPSIN FROM ASPERGILLUS PHOENICIS | 分子名称: | ASPERGILLOPEPSIN, ZINC ION, alpha-D-mannopyranose | 著者 | Cho, S.W, Shin, W. | 登録日 | 2001-03-28 | 公開日 | 2001-07-04 | 最終更新日 | 2020-07-29 | 実験手法 | X-RAY DIFFRACTION (2.14 Å) | 主引用文献 | Structure of aspergillopepsin I from Aspergillus phoenicis: variations of the S1'-S2 subsite in aspartic proteinases. Acta Crystallogr.,Sect.D, 57, 2001
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5ZW6
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![BU of 5zw6 by Molmil](/molmil-images/mine/5zw6) | Structure of spAimR | 分子名称: | AimR transcriptional regulator, GLY-MET-PRO-ARG-GLY-ALA | 著者 | Cheng, W, Dou, C. | 登録日 | 2018-05-14 | 公開日 | 2018-09-05 | 最終更新日 | 2024-03-27 | 実験手法 | X-RAY DIFFRACTION (2.05 Å) | 主引用文献 | Structural and functional insights into the regulation of the lysis-lysogeny decision in viral communities. Nat Microbiol, 3, 2018
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3NUR
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![BU of 3nur by Molmil](/molmil-images/mine/3nur) | Crystal structure of a putative amidohydrolase from Staphylococcus aureus | 分子名称: | Amidohydrolase, CALCIUM ION | 著者 | Qiu, W, Lam, R, Romanov, V, Lam, K, Soloveychik, M, Pai, E.F, Chirgadze, N.Y. | 登録日 | 2010-07-07 | 公開日 | 2011-07-13 | 実験手法 | X-RAY DIFFRACTION (1.75 Å) | 主引用文献 | Crystal structure of a putative amidohydrolase from Staphylococcus aureus To be Published
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1I4F
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![BU of 1i4f by Molmil](/molmil-images/mine/1i4f) | CRYSTAL STRUCTURE OF HLA-A*0201/MAGE-A4-PEPTIDE COMPLEX | 分子名称: | 2-(2-{2-[2-(2-METHOXY-ETHOXY)-ETHOXY]-ETHOXY}-ETHOXY)-ETHANOL, BETA-2-MICROGLOBULIN, HLA CLASS I HISTOCOMPATIBILITY ANTIGEN, ... | 著者 | Hillig, R.C, Coulie, P.G, Stroobant, V, Saenger, W, Ziegler, A, Huelsmeyer, M. | 登録日 | 2001-02-21 | 公開日 | 2001-07-25 | 最終更新日 | 2023-08-09 | 実験手法 | X-RAY DIFFRACTION (1.4 Å) | 主引用文献 | High-resolution structure of HLA-A*0201 in complex with a tumour-specific antigenic peptide encoded by the MAGE-A4 gene. J.Mol.Biol., 310, 2001
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3NR2
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![BU of 3nr2 by Molmil](/molmil-images/mine/3nr2) | Crystal structure of Caspase-6 zymogen | 分子名称: | Caspase-6 | 著者 | Su, X.-D, Wang, X.-J, Liu, X, Mi, W, Wang, K.-T. | 登録日 | 2010-06-30 | 公開日 | 2010-10-27 | 最終更新日 | 2023-11-01 | 実験手法 | X-RAY DIFFRACTION (2.9 Å) | 主引用文献 | Crystal structures of human caspase 6 reveal a new mechanism for intramolecular cleavage self-activation Embo Rep., 11, 2010
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3L43
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![BU of 3l43 by Molmil](/molmil-images/mine/3l43) | Crystal structure of the dynamin 3 GTPase domain bound with GDP | 分子名称: | Dynamin-3, GUANOSINE-5'-DIPHOSPHATE, UNKNOWN ATOM OR ION | 著者 | Yang, S, Tempel, W, Tong, Y, Nedyalkova, L, Guan, X, Crombet, L, Arrowsmith, C.H, Edwards, A.M, Bountra, C, Weigelt, J, Bochkarev, A, Park, H, Structural Genomics Consortium (SGC) | 登録日 | 2009-12-18 | 公開日 | 2010-01-19 | 最終更新日 | 2023-09-06 | 実験手法 | X-RAY DIFFRACTION (2.27 Å) | 主引用文献 | Crystal structure of the dynamin 3 GTPase domain bound with GDP to be published
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1M0Q
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![BU of 1m0q by Molmil](/molmil-images/mine/1m0q) | Structure of Dialkylglycine Decarboxylase Complexed with S-1-aminoethanephosphonate | 分子名称: | (1S)-1-[((1E)-{3-HYDROXY-2-METHYL-5-[(PHOSPHONOOXY)METHYL]PYRIDIN-4-YL}METHYLENE)AMINO]ETHYLPHOSPHONIC ACID, 2,2-Dialkylglycine Decarboxylase, POTASSIUM ION, ... | 著者 | Liu, W, Rogers, C.J, Fisher, A.J, Toney, M.D. | 登録日 | 2002-06-13 | 公開日 | 2002-10-23 | 最終更新日 | 2024-02-14 | 実験手法 | X-RAY DIFFRACTION (2 Å) | 主引用文献 | Aminophosphonate Inhibitors of Dialkylglycine Decarboxylase: Structural Basis for Slow Binding Inhibition Biochemistry, 41, 2002
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2PAU
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![BU of 2pau by Molmil](/molmil-images/mine/2pau) | Crystal structure of the 5'-deoxynucleotidase YfbR mutant E72A complexed with Co(2+) and dAMP | 分子名称: | 2'-DEOXYADENOSINE-5'-MONOPHOSPHATE, 5'-deoxynucleotidase YfbR, COBALT (II) ION, ... | 著者 | Zimmerman, M.D, Proudfoot, M, Yakunin, A, Minor, W. | 登録日 | 2007-03-27 | 公開日 | 2008-03-04 | 最終更新日 | 2023-08-30 | 実験手法 | X-RAY DIFFRACTION (2.1 Å) | 主引用文献 | Structural insight into the mechanism of substrate specificity and catalytic activity of an HD-domain phosphohydrolase: the 5'-deoxyribonucleotidase YfbR from Escherichia coli. J.Mol.Biol., 378, 2008
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3KGF
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![BU of 3kgf by Molmil](/molmil-images/mine/3kgf) | The structure of 3-deoxy-D-arabino-heptulosonate 7-phosphate synthase from Mycobacterium tuberculosis complexed with phenylalanine and tryptophan | 分子名称: | CHLORIDE ION, GLYCEROL, MANGANESE (II) ION, ... | 著者 | Parker, E.J, Jameson, G.B, Jiao, W, Webby, C.J, Baker, E.N, Baker, H.M, Mycobacterium Tuberculosis Structural Proteomics Project (XMTB) | 登録日 | 2009-10-29 | 公開日 | 2010-07-28 | 最終更新日 | 2023-11-01 | 実験手法 | X-RAY DIFFRACTION (2 Å) | 主引用文献 | Synergistic allostery, a sophisticated regulatory network for the control of aromatic amino acid biosynthesis in Mycobacterium tuberculosis J.Biol.Chem., 285, 2010
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6A5Q
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![BU of 6a5q by Molmil](/molmil-images/mine/6a5q) | |
3NSS
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![BU of 3nss by Molmil](/molmil-images/mine/3nss) | The 2009 pandemic H1N1 neuraminidase N1 lacks the 150-cavity in its active sites | 分子名称: | 2-acetamido-2-deoxy-beta-D-glucopyranose, ACETATE ION, CALCIUM ION, ... | 著者 | Li, Q, Qi, J.X, Zhang, W, Vavricka, C.J, Shi, Y, Gao, G.F. | 登録日 | 2010-07-02 | 公開日 | 2010-09-22 | 最終更新日 | 2023-12-27 | 実験手法 | X-RAY DIFFRACTION (1.902 Å) | 主引用文献 | The 2009 pandemic H1N1 neuraminidase N1 lacks the 150-cavity in its active site Nat.Struct.Mol.Biol., 17, 2010
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3KI8
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![BU of 3ki8 by Molmil](/molmil-images/mine/3ki8) | Crystal structure of hyperthermophilic nitrilase | 分子名称: | ACETIC ACID, Beta ureidopropionase (Beta-alanine synthase), MAGNESIUM ION | 著者 | Raczynska, J, Vorgias, C, Antranikian, G, Rypniewski, W. | 登録日 | 2009-10-31 | 公開日 | 2010-11-24 | 最終更新日 | 2023-09-06 | 実験手法 | X-RAY DIFFRACTION (1.6 Å) | 主引用文献 | Crystallographic analysis of a thermoactive nitrilase. J.Struct.Biol., 173, 2010
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3KKW
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![BU of 3kkw by Molmil](/molmil-images/mine/3kkw) | Crystal structure of His-tagged form of PA4794 protein | 分子名称: | 1,2-ETHANEDIOL, Putative uncharacterized protein, SULFATE ION | 著者 | Majorek, K.A, Chruszcz, M, Joachimiak, A, Minor, W, Midwest Center for Structural Genomics (MCSG) | 登録日 | 2009-11-06 | 公開日 | 2009-11-24 | 最終更新日 | 2023-09-06 | 実験手法 | X-RAY DIFFRACTION (1.41 Å) | 主引用文献 | Double trouble-Buffer selection and His-tag presence may be responsible for nonreproducibility of biomedical experiments. Protein Sci., 23, 2014
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