8R3W
 
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8R40
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8RAL
 | | CL3E peptide bound to the I-Ab murine MHC class II receptor | | Descriptor: | 1,2-ETHANEDIOL, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, CL3E peptide, ... | | Authors: | Erausquin, E, Urdiciain, A, Serra, P, Santamaria, P, Lopez-Sagaseta, J. | | Deposit date: | 2023-12-01 | | Release date: | 2024-11-06 | | Method: | X-RAY DIFFRACTION (2.1 Å) | | Cite: | CL3E peptide bound to the I-Ab murine MHC class II receptor
To be published
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8RLF
 | | Hydrogenated hen egg-white lysozyme at room temperature | | Descriptor: | ACETATE ION, Lysozyme C, NITRATE ION | | Authors: | Ramos, J, Laux, V, Mason, S.A, Lemee, M, Bowler, M, Diederichs, K, Haertlein, M, Forsyth, V.T, Mossou, E, Larsen, S, Langkilde, A.E. | | Deposit date: | 2024-01-03 | | Release date: | 2024-11-06 | | Method: | X-RAY DIFFRACTION (0.96 Å) | | Cite: | Hydrogenated hen egg-white lysozyme at room temperature
To Be Published
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8RLG
 | | Perdeuterated hen egg-white lysozyme at room temperature | | Descriptor: | ACETATE ION, Lysozyme C, NITRATE ION | | Authors: | Ramos, J, Laux, V, Mason, S.A, Lemee, M, Bowler, M, Diederichs, K, Haertlein, M, Forsyth, V.T, Mossou, E, Larsen, S, Langkilde, A.E. | | Deposit date: | 2024-01-03 | | Release date: | 2024-11-06 | | Method: | X-RAY DIFFRACTION (1.07 Å) | | Cite: | Perdeuterated hen egg-white lysozyme at room temperature
To Be Published
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8RLH
 | | Neutron structure of hydrogenated hen egg-white lysozyme at room temperature | | Descriptor: | ACETATE ION, Lysozyme C, NITRATE ION | | Authors: | Ramos, J, Laux, V, Mason, S.A, Lemee, M, Bowler, M, Diederichs, K, Haertlein, M, Forsyth, V.T, Mossou, E, Larsen, S, Langkilde, A.E. | | Deposit date: | 2024-01-03 | | Release date: | 2024-11-06 | | Method: | NEUTRON DIFFRACTION (1.1 Å) | | Cite: | Neutron structure of hydrogenated hen egg-white lysozyme at room temperature
To Be Published
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8RLI
 | | Neutron structure of perdeuterated hen egg-white lysozyme at room temperature | | Descriptor: | ACETATE ION, Lysozyme C, NITRATE ION | | Authors: | Ramos, J, Laux, V, Mason, S.A, Lemee, M, Bowler, M, Diederichs, K, Haertlein, M, Forsyth, V.T, Mossou, E, Larsen, S, Langkilde, A.E. | | Deposit date: | 2024-01-03 | | Release date: | 2024-11-06 | | Method: | NEUTRON DIFFRACTION (0.91 Å) | | Cite: | Neutron structure of perdeuterated hen egg-white lysozyme at room temperature
To Be Published
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8RPC
 | | Crystal structure of PfCLK3 with TCMDC-135051 | | Descriptor: | 1,2-ETHANEDIOL, 4-[2-[5-(diethylaminomethyl)-2-methoxy-phenyl]-1~{H}-pyrrolo[2,3-b]pyridin-4-yl]-2-propan-2-yl-benzoic acid, GLYCEROL, ... | | Authors: | Yelland, T.S, Benazir, A, Hole, A. | | Deposit date: | 2024-01-15 | | Release date: | 2024-11-06 | | Method: | X-RAY DIFFRACTION (2.079 Å) | | Cite: | Targeting Pf CLK3 with Covalent Inhibitors: A Novel Strategy for Malaria Treatment.
J.Med.Chem., 2024
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8RZA
 | | Ribonuclease W | | Descriptor: | MAGNESIUM ION, PHOSPHATE ION, Probable ribonuclease FAU-1, ... | | Authors: | Vayssieres, M, Blaud, M, Leulliot, N. | | Deposit date: | 2024-02-12 | | Release date: | 2024-11-06 | | Method: | X-RAY DIFFRACTION (2.1 Å) | | Cite: | RNase W, a conserved ribonuclease family with a novel active site.
Nucleic Acids Res., 2024
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8RZF
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8S00
 | | CpKRS complexed with lysine and an inhibitor | | Descriptor: | 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, 6-oxidanyl-~{N}-[(1-oxidanylcyclohexyl)methyl]-4-oxidanylidene-chromene-2-carboxamide, GLYCEROL, ... | | Authors: | Dawson, A, Baragana, B, Caldwell, N. | | Deposit date: | 2024-02-13 | | Release date: | 2024-11-06 | | Method: | X-RAY DIFFRACTION (2 Å) | | Cite: | Cryptosporidium lysyl-tRNA synthetase inhibitors define the interplay between solubility and permeability required to achieve efficacy.
Sci Transl Med, 16, 2024
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8S4J
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8S79
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8S85
 | | Crystal structure of JAK1 JH1 domain in complex with an inhibitor | | Descriptor: | SODIUM ION, Tyrosine-protein kinase JAK1, ~{N}-(2-ethylphenyl)-~{N},1-dimethyl-imidazo[4,5-c]pyridin-6-amine | | Authors: | Flower, T.F, Lopez-Ramos, M, Geney, R, Jestel, A. | | Deposit date: | 2024-03-05 | | Release date: | 2024-11-06 | | Method: | X-RAY DIFFRACTION (1.75 Å) | | Cite: | Design of a potent and selective dual JAK1/TYK2 inhibitor.
Bioorg.Med.Chem., 114, 2024
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8SSV
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8TCB
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8TF0
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8TVC
 | | Crystal structure of rA3G-ssDNA-AA | | Descriptor: | DNA 21-mer, DNA dC->dU-editing enzyme APOBEC-3G, PHOSPHATE ION, ... | | Authors: | Yang, H, Pacheco, J.I, Chen, X.S. | | Deposit date: | 2023-08-18 | | Release date: | 2024-11-06 | | Method: | X-RAY DIFFRACTION (1.93 Å) | | Cite: | Molecular mechanism for regulating APOBEC3G DNA editing function by the non-catalytic domain.
Nat Commun, 15, 2024
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8TX4
 | | Crystal Structure of rA3G-ssDNA-GA | | Descriptor: | DNA 22-mer with (5'-D(P*TP*GP*AP*TP*TP)-3'), DNA dC->dU-editing enzyme APOBEC-3G, PHOSPHATE ION, ... | | Authors: | Yang, H, Pacheco, J.I, Chen, X.S. | | Deposit date: | 2023-08-22 | | Release date: | 2024-11-06 | | Method: | X-RAY DIFFRACTION (1.9 Å) | | Cite: | Molecular mechanism for regulating APOBEC3G DNA editing function by the non-catalytic domain.
Nat Commun, 15, 2024
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8TX8
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8U25
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8ULH
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8ULJ
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8ULK
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8UOJ
 | | Crystal structure of human NUAK1-MARK3 kinase domain chimera bound with azepane (R)-#50 small molecule inhibitor | | Descriptor: | (6M)-4-{[(2R)-azepan-2-yl]methyl}-6-[(4R)-imidazo[1,2-a]pyridin-3-yl]-2H-pyrido[3,2-b][1,4]oxazin-3(4H)-one, 1,2-ETHANEDIOL, BENZOIC ACID, ... | | Authors: | Delker, S.L, Abendroth, J, Mayclin, S.J. | | Deposit date: | 2023-10-19 | | Release date: | 2024-11-06 | | Method: | X-RAY DIFFRACTION (1.6 Å) | | Cite: | Discovery of UCB9386 a Potent, Selective and Brain-Penetrant Nuak1 Inhibitor suitable for in vivo Pharmacological Studies
To Be Published
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