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8F85	Crystal Structure of Dihydrofolate reductase (DHFR) from Mycobacterium ulcerans Agy99 in complex with NADP and inhibitor MAM851 Descriptor: 3-{2-[3-({(6M)-2,4-diamino-6-[2-(trifluoromethyl)phenyl]pyrimidin-5-yl}oxy)propoxy]phenyl}propanoic acid, Dihydrofolate reductase, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE Authors: Seattle Structural Genomics Center for Infectious Disease, Seattle Structural Genomics Center for Infectious Disease (SSGCID) Deposit date: 2022-11-21 Release date: 2023-12-13 Method: X-RAY DIFFRACTION (1.15 Å) Cite: Crystal Structure of Dihydrofolate reductase (DHFR) from Mycobacterium ulcerans Agy99 in complex with NADP and inhibitor MAM851 To be published
8G4Z	E. coli DHFR complex with NADP+ and folate: EF-X off model by Laue diffraction (no electric field) Descriptor: Dihydrofolate reductase, FOLIC ACID, MANGANESE (II) ION, ... Authors: Greisman, J.B, Dalton, K.M, Brookner, D.E, Klureza, M.A, Hekstra, D.R. Deposit date: 2023-02-10 Release date: 2024-01-03 Method: X-RAY DIFFRACTION (1.7 Å) Cite: E. coli DHFR complex with NADP+ and folate: EF-X off model by Laue diffraction (no electric field) To Be Published
8G50	E. coli DHFR complex with NADP+ and folate: EF-X excited state model by Laue diffraction (electric field along b axis; 8-fold extrapolation of structure factor differences) Descriptor: Dihydrofolate reductase, FOLIC ACID, MANGANESE (II) ION, ... Authors: Greisman, J.B, Dalton, K.M, Brookner, D.E, Klureza, M.A, Hekstra, D.R. Deposit date: 2023-02-10 Release date: 2024-01-03 Method: X-RAY DIFFRACTION (1.7 Å) Cite: E. coli DHFR complex with NADP+ and folate: EF-X excited state model by Laue diffraction (electric field along b axis; 8-fold extrapolation of structure factor differences) To Be Published
8HCO	Substrate-engaged TOM complex from yeast Descriptor: Mitochondrial import receptor subunit TOM22, Mitochondrial import receptor subunit TOM40, Mitochondrial import receptor subunit TOM5, ... Authors: Zhou, X.Y, Yang, Y.Q, Wang, G.P, Wang, S.S. Deposit date: 2022-11-02 Release date: 2023-09-13 Last modified: 2023-12-27 Method: ELECTRON MICROSCOPY (4.1 Å) Cite: Molecular pathway of mitochondrial preprotein import through the TOM-TIM23 supercomplex. Nat.Struct.Mol.Biol., 30, 2023
8JFB	V1/S quadruple mutant Plasmodium falciparum dihydrofolate reductase-thymidylate synthase (PfDHFR-TS) complexed with compound 4 (B21588), NADPH and dUMP Descriptor: 2'-DEOXYURIDINE 5'-MONOPHOSPHATE, 3-[4-[[2,4-bis(azanyl)-6-ethyl-pyrimidin-5-yl]methyl]phenyl]benzoic acid, Bifunctional dihydrofolate reductase-thymidylate synthase, ... Authors: Vanichtanankul, J, Saeyang, T, Vitsupakorn, D, Saepua, S, Thongpanchang, C, Yuthavong, Y, Kamchonwongpaisan, S, Hoarau, M. Deposit date: 2023-05-17 Release date: 2023-08-23 Last modified: 2023-10-04 Method: X-RAY DIFFRACTION (2.65 Å) Cite: Discovery of rigid biphenyl Plasmodium falciparum DHFR inhibitors using a fragment linking strategy. Rsc Med Chem, 14, 2023
8JFC	V1/S quadruple mutant Plasmodium falciparum dihydrofolate reductase-thymidylate synthase (PfDHFR-TS) complexed with compound 6 (B21591), NADPH and dUMP Descriptor: 2'-DEOXYURIDINE 5'-MONOPHOSPHATE, 4-[3-[[2,4-bis(azanyl)-6-ethyl-pyrimidin-5-yl]methyl]phenyl]benzoic acid, Bifunctional dihydrofolate reductase-thymidylate synthase, ... Authors: Vanichtanankul, J, Saeyang, T, Vitsupakorn, D, Saepua, S, Thongpanchang, C, Yuthavong, Y, Kamchonwongpaisan, S, Hoarau, M. Deposit date: 2023-05-17 Release date: 2023-08-23 Last modified: 2023-10-04 Method: X-RAY DIFFRACTION (2.3 Å) Cite: Discovery of rigid biphenyl Plasmodium falciparum DHFR inhibitors using a fragment linking strategy. Rsc Med Chem, 14, 2023
8JFD	V1/S quadruple mutant Plasmodium falciparum dihydrofolate reductase-thymidylate synthase (PfDHFR-TS) complexed with compound 8 (B21594), NADPH and dUMP Descriptor: 2'-DEOXYURIDINE 5'-MONOPHOSPHATE, 3-[3-[[2,4-bis(azanyl)-6-ethyl-pyrimidin-5-yl]methyl]phenyl]benzoic acid, Bifunctional dihydrofolate reductase-thymidylate synthase, ... Authors: Vanichtanankul, J, Saeyang, T, Vitsupakorn, D, Saepua, S, Thongpanchang, C, Yuthavong, Y, Kamchonwongpaisan, S, Hoarau, M. Deposit date: 2023-05-17 Release date: 2023-08-23 Last modified: 2023-10-04 Method: X-RAY DIFFRACTION (2.3 Å) Cite: Discovery of rigid biphenyl Plasmodium falciparum DHFR inhibitors using a fragment linking strategy. Rsc Med Chem, 14, 2023
8SSX	Crystal structure of Bacillus anthracis dihydrofolate reductase at 1.65-A resolution Descriptor: 1,2-ETHANEDIOL, Dihydrofolate reductase, SULFATE ION Authors: Shaw, G.X, Li, Y, Wu, Y, Yan, H, Ji, X. Deposit date: 2023-05-09 Release date: 2023-05-17 Last modified: 2024-05-22 Method: X-RAY DIFFRACTION (1.65 Å) Cite: Crystal structure of Bacillus anthracis dihydrofolate reductase at 1.65-A resolution To be published
8SZD	Crystal structure of Yersinia pestis dihydrofolate reductase at 1.25-A resolution Descriptor: CHLORIDE ION, Dihydrofolate reductase, MAGNESIUM ION, ... Authors: Shaw, G.X, Cherry, S, Tropea, J.E, Waugh, D.S, Ji, X. Deposit date: 2023-05-29 Release date: 2023-06-07 Last modified: 2024-05-22 Method: X-RAY DIFFRACTION (1.25 Å) Cite: Crystal structure of Yersinia pestis dihydrofolate reductase at 1.25-A resolution To be published
8SZE	Crystal structure of Yersinia pestis dihydrofolate reductase in complex with Trimethoprim Descriptor: 1,2-ETHANEDIOL, CHLORIDE ION, Dihydrofolate reductase, ... Authors: Shaw, G.X, Cherry, S, Tropea, J.E, Waugh, D.S, Ji, X. Deposit date: 2023-05-29 Release date: 2023-06-07 Last modified: 2024-05-22 Method: X-RAY DIFFRACTION (2.5 Å) Cite: Crystal structure of Yersinia pestis dihydrofolate reductase in complex with Trimethoprim To be published
8UCX	Dihydrofolate Reductase Complexed with Folate Descriptor: Dihydrofolate reductase, FOLIC ACID, MANGANESE (II) ION Authors: Fried, S.D.E, Boxer, S.G. Deposit date: 2023-09-27 Release date: 2023-10-11 Last modified: 2023-11-15 Method: X-RAY DIFFRACTION (1.57 Å) Cite: Role of Electrostatics in Hydride Transfer by Dihydrofolate Reductase To Be Published
8UVZ	Bacillus subtilis DHFR bound to NADP+ and folate Descriptor: Dihydrofolate reductase, FOLIC ACID, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, ... Authors: Smith, N, Horswill, A.R, Wilson, M.A. Deposit date: 2023-11-05 Release date: 2023-11-15 Method: X-RAY DIFFRACTION (0.93 Å) Cite: Bacillus subtilis DHFR bound to NADP+ and folate To Be Published
8UW0	Escherichia coli DHFR bound to NADP+ and folate, 17.2 MGy dose Descriptor: Dihydrofolate reductase, FOLIC ACID, MANGANESE (II) ION, ... Authors: Smith, N, Horswill, A.R, Wilson, M.A. Deposit date: 2023-11-05 Release date: 2023-11-15 Method: X-RAY DIFFRACTION (0.93 Å) Cite: X-ray-driven chemistry and conformational heterogeneity in atomic resolution crystal structures of bacterial dihydrofolate reductases To Be Published
8VZ4	L54G Mutant of E. coli Dihydrofolate Reductase Complexed with Nicotinamide Adenine Dinucleotide Phosphate (oxidized form) Descriptor: Dihydrofolate reductase, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE Authors: Fried, S.D.E, Boxer, S.G. Deposit date: 2024-02-09 Release date: 2024-04-17 Method: X-RAY DIFFRACTION (1.25 Å) Cite: Role of Electrostatics in Hydride Transfer by Dihydrofolate Reductase To Be Published

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