3RN8
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5CGO
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![BU of 5cgo by Molmil](/molmil-images/mine/5cgo) | Structure of quasiracemic Ala-Magainin 2 with a beta amino acid substitution at position 13 | 分子名称: | ACPC-13 derivative of Ala-Magainin 2, D-Ala-Magainin 2 | 著者 | Hayouka, Z, Thomas, N.C, Mortenson, D.E, Satyshur, K.A, Weisblum, B, Forest, K.T, Gellman, S.H. | 登録日 | 2015-07-09 | 公開日 | 2015-09-23 | 最終更新日 | 2023-11-15 | 実験手法 | X-RAY DIFFRACTION (1.5 Å) | 主引用文献 | Quasiracemate Crystal Structures of Magainin 2 Derivatives Support the Functional Significance of the Phenylalanine Zipper Motif. J.Am.Chem.Soc., 137, 2015
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3SNF
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![BU of 3snf by Molmil](/molmil-images/mine/3snf) | Onconase, atomic resolution crystal structure | 分子名称: | ACETATE ION, Protein P-30, SULFATE ION | 著者 | Holloway, D.E, Singh, U.P, Shogen, K, Acharya, K.R. | 登録日 | 2011-06-29 | 公開日 | 2011-10-05 | 最終更新日 | 2023-09-13 | 実験手法 | X-RAY DIFFRACTION (1.1 Å) | 主引用文献 | Crystal structure of Onconase at 1.1 angstrom resolution--insights into substrate binding and collective motion. Febs J., 278, 2011
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5C17
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![BU of 5c17 by Molmil](/molmil-images/mine/5c17) | Crystal structure of the mercury-bound form of MerB2 | 分子名称: | (2S,3S)-1,4-DIMERCAPTOBUTANE-2,3-DIOL, GLYCEROL, MERCURY (II) ION, ... | 著者 | Wahba, H.M, Lecoq, L, Stevenson, M, Mansour, A, Cappadocia, L, Lafrance-Vanasse, J, Wilkinson, K.J, Sygusch, J, Wilcox, D.E, Omichinski, J.G. | 登録日 | 2015-06-13 | 公開日 | 2016-02-03 | 最終更新日 | 2023-09-27 | 実験手法 | X-RAY DIFFRACTION (1.24 Å) | 主引用文献 | Structural and Biochemical Characterization of a Copper-Binding Mutant of the Organomercurial Lyase MerB: Insight into the Key Role of the Active Site Aspartic Acid in Hg-Carbon Bond Cleavage and Metal Binding Specificity. Biochemistry, 55, 2016
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4ZSM
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![BU of 4zsm by Molmil](/molmil-images/mine/4zsm) | BACE crystal structure with bicyclic aminothiazine fragment | 分子名称: | (4aS,8aR)-4a,5,6,7,8,8a-hexahydro-4H-3,1-benzothiazin-2-amine, Beta-secretase 1, GLYCEROL | 著者 | Timm, D.E. | 登録日 | 2015-05-13 | 公開日 | 2015-06-10 | 最終更新日 | 2015-06-17 | 実験手法 | X-RAY DIFFRACTION (1.96 Å) | 主引用文献 | Preparation and biological evaluation of conformationally constrained BACE1 inhibitors. Bioorg.Med.Chem., 23, 2015
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4ZSQ
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![BU of 4zsq by Molmil](/molmil-images/mine/4zsq) | BACE crystal structure with tricyclic aminothiazine inhibitor | 分子名称: | Beta-secretase 1, GLYCEROL, N-[(4S,4aS,6S,8aR)-10-aminohexahydro-3H-4,8a-(epithiomethenoazeno)isochromen-6(1H)-yl]-3-chlorobenzamide | 著者 | Timm, D.E. | 登録日 | 2015-05-13 | 公開日 | 2015-06-10 | 最終更新日 | 2015-06-17 | 実験手法 | X-RAY DIFFRACTION (2.3 Å) | 主引用文献 | Preparation and biological evaluation of conformationally constrained BACE1 inhibitors. Bioorg.Med.Chem., 23, 2015
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5D85
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![BU of 5d85 by Molmil](/molmil-images/mine/5d85) | Staphyloferrin B precursor biosynthetic enzyme SbnA bound to aminoacrylate intermediate | 分子名称: | 2-[({3-HYDROXY-2-METHYL-5-[(PHOSPHONOOXY)METHYL]PYRIDIN-4-YL}METHYL)AMINO]ACRYLIC ACID, CITRATE ANION, GLYCEROL, ... | 著者 | Kobylarz, M.J, Grigg, J.C, Liu, Y, Lee, M.S.F, Heinrichs, D.E, Murphy, M.E.P. | 登録日 | 2015-08-15 | 公開日 | 2016-02-03 | 最終更新日 | 2024-03-06 | 実験手法 | X-RAY DIFFRACTION (1.92 Å) | 主引用文献 | Deciphering the Substrate Specificity of SbnA, the Enzyme Catalyzing the First Step in Staphyloferrin B Biosynthesis. Biochemistry, 55, 2016
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3QE0
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![BU of 3qe0 by Molmil](/molmil-images/mine/3qe0) | A Galpha-i1 P-loop mutation prevents transition to the activated state | 分子名称: | GUANOSINE-5'-DIPHOSPHATE, Guanine nucleotide-binding protein G(i) subunit alpha-1, KB752 peptide, ... | 著者 | Bosch, D.E, Willard, F.S, Kimple, A.J, Miley, M.J, Siderovski, D.P. | 登録日 | 2011-01-19 | 公開日 | 2012-01-25 | 最終更新日 | 2023-09-13 | 実験手法 | X-RAY DIFFRACTION (3 Å) | 主引用文献 | A P-loop Mutation in Galpha Subunits Prevents Transition to the Active State: Implications for G-protein Signaling in Fungal Pathogenesis Plos Pathog., 8, 2012
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3QGK
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5D86
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![BU of 5d86 by Molmil](/molmil-images/mine/5d86) | Staphyloferrin B precursor biosynthetic enzyme SbnA Y152F variant | 分子名称: | 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, MAGNESIUM ION, PYRIDOXAL-5'-PHOSPHATE, ... | 著者 | Kobylarz, M.J, Grigg, J.C, Liu, Y, Lee, M.S.F, Heinrichs, D.E, Murphy, M.E.P. | 登録日 | 2015-08-15 | 公開日 | 2016-02-03 | 最終更新日 | 2020-01-08 | 実験手法 | X-RAY DIFFRACTION (1.5 Å) | 主引用文献 | Deciphering the Substrate Specificity of SbnA, the Enzyme Catalyzing the First Step in Staphyloferrin B Biosynthesis. Biochemistry, 55, 2016
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5C0U
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![BU of 5c0u by Molmil](/molmil-images/mine/5c0u) | Crystal structure of the copper-bound form of MerB mutant D99S | 分子名称: | Alkylmercury lyase, BROMIDE ION, COPPER (II) ION | 著者 | Wahba, H.M, Lecoq, L, Stevenson, M, Mansour, A, Cappadocia, L, Lafrance-Vanasse, J, Wilkinson, K.J, Sygusch, J, Wilcox, D.E, Omichinski, J.G. | 登録日 | 2015-06-12 | 公開日 | 2016-02-03 | 最終更新日 | 2023-09-27 | 実験手法 | X-RAY DIFFRACTION (1.87 Å) | 主引用文献 | Structural and Biochemical Characterization of a Copper-Binding Mutant of the Organomercurial Lyase MerB: Insight into the Key Role of the Active Site Aspartic Acid in Hg-Carbon Bond Cleavage and Metal Binding Specificity. Biochemistry, 55, 2016
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5C23
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![BU of 5c23 by Molmil](/molmil-images/mine/5c23) | Parkin (S65DUblR0RBR) | 分子名称: | CHLORIDE ION, E3 ubiquitin-protein ligase parkin, GLYCEROL, ... | 著者 | Kumar, A, Aguirre, J.D, Condos, T.E.C, Martinez-Torres, R.J, Chaugule, V.K, Toth, R, Sundaramoorthy, R, Mercier, P, Knebel, A, Spratt, D.E, Barber, K.R, Shaw, G.S, Walden, H. | 登録日 | 2015-06-15 | 公開日 | 2015-07-29 | 最終更新日 | 2024-01-10 | 実験手法 | X-RAY DIFFRACTION (2.37 Å) | 主引用文献 | Disruption of the autoinhibited state primes the E3 ligase parkin for activation and catalysis. Embo J., 34, 2015
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3QGA
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3REF
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![BU of 3ref by Molmil](/molmil-images/mine/3ref) | Crystal structure of EhRho1 bound to GDP and Magnesium | 分子名称: | GUANOSINE-5'-DIPHOSPHATE, MAGNESIUM ION, Rho-like small GTPase, ... | 著者 | Bosch, D.E, Qiu, C, Siderovski, D.P. | 登録日 | 2011-04-04 | 公開日 | 2011-09-28 | 最終更新日 | 2023-09-13 | 実験手法 | X-RAY DIFFRACTION (1.95 Å) | 主引用文献 | Unique structural and nucleotide exchange features of the Rho1 GTPase of Entamoeba histolytica. J.Biol.Chem., 286, 2011
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3TRW
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5D87
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![BU of 5d87 by Molmil](/molmil-images/mine/5d87) | Staphyloferrin B precursor biosynthetic enzyme SbnA Y152F/S185G variant | 分子名称: | MAGNESIUM ION, POTASSIUM ION, PYRIDOXAL-5'-PHOSPHATE, ... | 著者 | Kobylarz, M.J, Grigg, J.C, Liu, Y, Lee, M.S.F, Heinrichs, D.E, Murphy, M.E.P. | 登録日 | 2015-08-15 | 公開日 | 2016-02-03 | 最終更新日 | 2020-01-08 | 実験手法 | X-RAY DIFFRACTION (1.5 Å) | 主引用文献 | Deciphering the Substrate Specificity of SbnA, the Enzyme Catalyzing the First Step in Staphyloferrin B Biosynthesis. Biochemistry, 55, 2016
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3TJW
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![BU of 3tjw by Molmil](/molmil-images/mine/3tjw) | Crystal Structure of Quasiracemic Villin Headpiece Subdomain Containing (F5Phe10) Substitution | 分子名称: | D-Villin-1, L-Villin-1, SULFATE ION | 著者 | Mortenson, D.E, Satyshur, K.A, Gellman, S.H, Forest, K.T. | 登録日 | 2011-08-25 | 公開日 | 2012-01-25 | 最終更新日 | 2017-11-08 | 実験手法 | X-RAY DIFFRACTION (1.46 Å) | 主引用文献 | Quasiracemic crystallization as a tool to assess the accommodation of noncanonical residues in nativelike protein conformations. J.Am.Chem.Soc., 134, 2012
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3TND
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![BU of 3tnd by Molmil](/molmil-images/mine/3tnd) | Crystal structure of Shigella flexneri VapBC toxin-antitoxin complex | 分子名称: | Antitoxin VapB, SODIUM ION, SULFATE ION, ... | 著者 | Dienemann, C, Boggild, A, Winther, K.S, Gerdes, K, Brodersen, D.E. | 登録日 | 2011-09-01 | 公開日 | 2011-11-02 | 最終更新日 | 2024-02-28 | 実験手法 | X-RAY DIFFRACTION (2.7 Å) | 主引用文献 | Crystal Structure of the VapBC Toxin-Antitoxin Complex from Shigella flexneri Reveals a Hetero-Octameric DNA-Binding Assembly. J.Mol.Biol., 414, 2011
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3R7D
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![BU of 3r7d by Molmil](/molmil-images/mine/3r7d) | Crystal Structure of Unliganded Aspartate Transcarbamoylase from Bacillus subtilis | 分子名称: | Aspartate carbamoyltransferase, PHOSPHATE ION | 著者 | Puleo, D.E, Harris, K.M, Cockrell, G.M, Kantrowitz, E.R. | 登録日 | 2011-03-22 | 公開日 | 2011-06-08 | 最終更新日 | 2024-02-21 | 実験手法 | X-RAY DIFFRACTION (2.196 Å) | 主引用文献 | Crystallographic Snapshots of the Complete Catalytic Cycle of the Unregulated Aspartate Transcarbamoylase from Bacillus subtilis. J.Mol.Biol., 411, 2011
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3RNN
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3TRV
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![BU of 3trv by Molmil](/molmil-images/mine/3trv) | Crystal structure of quasiracemic villin headpiece subdomain containing (F5Phe17) substitution | 分子名称: | D-Villin-1, ISOPROPYL ALCOHOL, L-Villin-1, ... | 著者 | Mortenson, D.E, Satyshur, K.A, Gellman, S.H, Forest, K.T. | 登録日 | 2011-09-11 | 公開日 | 2012-01-25 | 最終更新日 | 2017-11-08 | 実験手法 | X-RAY DIFFRACTION (1 Å) | 主引用文献 | Quasiracemic crystallization as a tool to assess the accommodation of noncanonical residues in nativelike protein conformations. J.Am.Chem.Soc., 134, 2012
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3TRY
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![BU of 3try by Molmil](/molmil-images/mine/3try) | Crystal structure of racemic villin headpiece subdomain in space group I-4c2 | 分子名称: | D-Villin-1, SULFATE ION | 著者 | Mortenson, D.E, Satyshur, K.A, Gellman, S.H, Forest, K.T. | 登録日 | 2011-09-11 | 公開日 | 2012-01-25 | 最終更新日 | 2023-12-06 | 実験手法 | X-RAY DIFFRACTION (2.3 Å) | 主引用文献 | Quasiracemic crystallization as a tool to assess the accommodation of noncanonical residues in nativelike protein conformations. J.Am.Chem.Soc., 134, 2012
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6TW3
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![BU of 6tw3 by Molmil](/molmil-images/mine/6tw3) | HumRadA2 in complex with Naphthyl-HPA fragment-peptide chimera | 分子名称: | (2~{S})-1-[(2~{S})-2-[(3-azanylnaphthalen-2-yl)carbonylamino]-3-(1~{H}-imidazol-4-yl)propanoyl]-~{N}-[(2~{S})-1-azanyl-1-oxidanylidene-propan-2-yl]pyrrolidine-2-carboxamide, DNA repair and recombination protein RadA, PHOSPHATE ION | 著者 | Marsh, M.E, Fischer, G, Scott, D.E, Coyne, A.G, Skidmore, J, Abell, C, Hyvonen, M. | 登録日 | 2020-01-12 | 公開日 | 2021-01-27 | 最終更新日 | 2024-01-24 | 実験手法 | X-RAY DIFFRACTION (1.352 Å) | 主引用文献 | A small-molecule inhibitor of the BRCA2-RAD51 interaction modulates RAD51 assembly and potentiates DNA damage-induced cell death. Cell Chem Biol, 28, 2021
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4BCA
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![BU of 4bca by Molmil](/molmil-images/mine/4bca) | MAMMALIAN ALKYLDIHYDROXYACETONEPHOSPHATE SYNTHASE: Tyr578Phe mutant | 分子名称: | ALKYLDIHYDROXYACETONEPHOSPHATE SYNTHASE, PEROXISOMAL, CHLORIDE ION, ... | 著者 | Nenci, S, Piano, V, Rosati, S, Aliverti, A, Pandini, V, Fraaije, M.W, Heck, A.J.R, Edmondson, D.E, Mattevi, A. | 登録日 | 2012-10-01 | 公開日 | 2012-11-07 | 最終更新日 | 2023-12-20 | 実験手法 | X-RAY DIFFRACTION (2.4 Å) | 主引用文献 | Precursor of Ether Phospholipids is Synthesized by a Flavoenzyme Through Covalent Catalysis. Proc.Natl.Acad.Sci.USA, 109, 2012
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4B2I
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![BU of 4b2i by Molmil](/molmil-images/mine/4b2i) | Humanised monomeric RadA in complex with indazole | 分子名称: | 1H-indazole, DNA REPAIR AND RECOMBINATION PROTEIN RADA, PHOSPHATE ION | 著者 | Scott, D.E, Ehebauer, M.T, Pukala, T, Marsh, M, Blundell, T.L, Venkitaraman, A.R, Abell, C, Hyvonen, M. | 登録日 | 2012-07-16 | 公開日 | 2013-02-06 | 最終更新日 | 2023-12-20 | 実験手法 | X-RAY DIFFRACTION (1.3 Å) | 主引用文献 | Using a Fragment-Based Approach to Target Protein-Protein Interactions. Chembiochem, 14, 2013
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