8UVW
 
 | | Crystal structure of RAD51-BRCA2 Cter complex | | Descriptor: | 1,2-ETHANEDIOL, ADENOSINE-5'-DIPHOSPHATE, BERYLLIUM TRIFLUORIDE ION, ... | | Authors: | Longo, M.A, Perera, R, Tsai, C.-L, Tainer, J.A. | | Deposit date: | 2023-11-05 | | Release date: | 2024-11-06 | | Method: | X-RAY DIFFRACTION (2.73 Å) | | Cite: | Molecular Recognition of RAD51 by the BRCA2 Carboxy Terminal Domain
To Be Published
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8UWN
 | | Crystal structure of human CLK1 kinase in complex with compound 3 | | Descriptor: | Dual specificity protein kinase CLK1, SULFATE ION, cyclopropyl(4-{(8R)-6-[4-(piperazin-1-yl)phenyl]pyrrolo[1,2-b]pyridazin-4-yl}piperazin-1-yl)methanone | | Authors: | Kim, J.L. | | Deposit date: | 2023-11-07 | | Release date: | 2024-11-06 | | Method: | X-RAY DIFFRACTION (1.8 Å) | | Cite: | An ALK2 inhibitor, BLU-782, prevents heterotopic ossification in a mouse model of fibrodysplasia ossificans progressiva.
Sci Transl Med, 16, 2024
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8UWR
 | | Crystal structure of human ACVR1 (ALK2) kinase in complex with compound 3 | | Descriptor: | Activin receptor type-1, SULFATE ION, cyclopropyl(4-{(8R)-6-[4-(piperazin-1-yl)phenyl]pyrrolo[1,2-b]pyridazin-4-yl}piperazin-1-yl)methanone | | Authors: | Kim, J.L. | | Deposit date: | 2023-11-07 | | Release date: | 2024-11-06 | | Method: | X-RAY DIFFRACTION (2.04 Å) | | Cite: | An ALK2 inhibitor, BLU-782, prevents heterotopic ossification in a mouse model of fibrodysplasia ossificans progressiva.
Sci Transl Med, 16, 2024
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8V5U
 | | Human SIRT3 bound to p53-AMC peptide and Honokiol | | Descriptor: | (1P)-3',5-di(prop-2-en-1-yl)[1,1'-biphenyl]-2,4'-diol, NAD-dependent protein deacetylase sirtuin-3, mitochondrial, ... | | Authors: | Chakrabarti, R, Ghosh, A, Guan, X, Upadhyay, A, Dumpati, R.K, Munshi, S, Roy, S, Chall, S, Rahnamoun, A, Reverdy, C, Errasti, G, Delacroix, T. | | Deposit date: | 2023-12-01 | | Release date: | 2024-11-06 | | Method: | X-RAY DIFFRACTION (1.48 Å) | | Cite: | Computationally Driven Discovery and Characterization of SIRT3-Activating Compounds that Fully Recover Catalytic Activity under ${\mathrm{NAD}}^{+}$ Depletion
Phys. Rev. X, 14, 2024
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8VA9
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8VAB
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8VAG
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8VAI
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8VAU
 | | Nicotinamide Riboside and CD38: Covalent Inhibition and Live-Cell Labeling | | Descriptor: | ADP-ribosyl cyclase/cyclic ADP-ribose hydrolase 1, Nicotinamide riboside, alpha-D-ribofuranose | | Authors: | Kao, G, Zhang, X.N, Nasertorabi, F, Katz, B.B, Li, Z, Dai, Z, Zhang, Z, Zhang, L, Louie, S.G, Cherezov, V, Zhang, Y. | | Deposit date: | 2023-12-11 | | Release date: | 2024-11-06 | | Method: | X-RAY DIFFRACTION (2.1 Å) | | Cite: | Nicotinamide Riboside and CD38: Covalent Inhibition and Live-Cell Labeling
Jacs Au, 2024
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8VGA
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8VGB
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8VIP
 | | Crystal structure of the N-terminal domain of fatty acid kinase A (FakA) from Staphylococcus aureus (Mn and AMP-PNP) | | Descriptor: | FATTY ACID KINASE A, MANGANESE (II) ION, PHOSPHOAMINOPHOSPHONIC ACID-ADENYLATE ESTER | | Authors: | Lovell, S, Kashipathy, M.M, Battaile, K.P, Bose, J.L. | | Deposit date: | 2024-01-05 | | Release date: | 2024-11-06 | | Method: | X-RAY DIFFRACTION (1.77 Å) | | Cite: | Molecular insights into the structure and function of the Staphylococcus aureus fatty acid kinase
J.Biol.Chem., 2024
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8VIQ
 | | Crystal structure of the N-terminal domain of fatty acid kinase A (FakA) from Staphylococcus aureus (Mg and AMP-PNP) | | Descriptor: | FATTY ACID KINASE A, MAGNESIUM ION, PHOSPHOAMINOPHOSPHONIC ACID-ADENYLATE ESTER | | Authors: | Lovell, S, Kashipathy, M.M, Battaile, K.P, Bose, J.L. | | Deposit date: | 2024-01-05 | | Release date: | 2024-11-06 | | Method: | X-RAY DIFFRACTION (1.1 Å) | | Cite: | Molecular insights into the structure and function of the Staphylococcus aureus fatty acid kinase
J.Biol.Chem., 2024
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8VIR
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8VIT
 | | Crystal structure of the N-terminal domain of fatty acid kinase A (FakA) from Staphylococcus aureus (Mg and ADP) | | Descriptor: | ADENOSINE-5'-DIPHOSPHATE, FATTY ACID KINASE A, MAGNESIUM ION, ... | | Authors: | Lovell, S, Kashipathy, M.M, Battaile, K.P, Bose, J.L. | | Deposit date: | 2024-01-05 | | Release date: | 2024-11-06 | | Method: | X-RAY DIFFRACTION (1.25 Å) | | Cite: | Molecular insights into the structure and function of the Staphylococcus aureus fatty acid kinase
J.Biol.Chem., 2024
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8VJD
 | | Human R14A Pin1 covalently bound to inhibitor 158F10 in P21 21 21 space group | | Descriptor: | 3,6,9,12,15,18-HEXAOXAICOSANE-1,20-DIOL, Inhibitor 158F10, Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1, ... | | Authors: | Rodriguez, I, Blaha, G. | | Deposit date: | 2024-01-06 | | Release date: | 2024-11-06 | | Method: | X-RAY DIFFRACTION (1.57 Å) | | Cite: | Targeted Degradation of Pin1 by Protein Destabilizing Compounds
To Be Published
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8VJE
 | | Human R14A Pin1 covalently bound to inhibitor 158F10 | | Descriptor: | 2,3-DIHYDROXY-1,4-DITHIOBUTANE, 3,6,9,12,15,18-HEXAOXAICOSANE-1,20-DIOL, Inhibitor 158F10, ... | | Authors: | Rodriguez, I, Blaha, G. | | Deposit date: | 2024-01-06 | | Release date: | 2024-11-06 | | Method: | X-RAY DIFFRACTION (1.7 Å) | | Cite: | Targeted Degradation of Pin1 by Protein Destabilizing Compounds
To Be Published
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8VJF
 | | Human R14A Pin1 covalently bound to inhibitor 158D9 | | Descriptor: | 2,3-DIHYDROXY-1,4-DITHIOBUTANE, 3,6,9,12,15,18-HEXAOXAICOSANE-1,20-DIOL, Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1, ... | | Authors: | Rodriguez, I, Blaha, G. | | Deposit date: | 2024-01-06 | | Release date: | 2024-11-06 | | Method: | X-RAY DIFFRACTION (1.7 Å) | | Cite: | Targeted Degradation of Pin1 by Protein Destabilizing Compounds
To Be Published
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8VJG
 | | Human R14A Pin1 covalently bound to inhibitor 164A10 | | Descriptor: | 2,3-DIHYDROXY-1,4-DITHIOBUTANE, 3,6,9,12,15,18-HEXAOXAICOSANE-1,20-DIOL, Nalpha-{(2S)-1-[(3S)-2-acetyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carbonyl]piperidine-2-carbonyl}-5-fluoro-L-tryptophanamide, ... | | Authors: | Rodriguez, I, Blaha, G. | | Deposit date: | 2024-01-06 | | Release date: | 2024-11-06 | | Method: | X-RAY DIFFRACTION (1.58 Å) | | Cite: | Targeted Degradation of Pin1 by Protein Destabilizing Compounds
To Be Published
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8VYD
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8WEB
 | | Crystal structure of Arabidopsis thaliana MIK2 ectodomain | | Descriptor: | 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, MDIS1-interacting receptor like kinase 2 | | Authors: | Wan, L.H, Hu, Y.X, Wu, H.M. | | Deposit date: | 2023-09-17 | | Release date: | 2024-11-06 | | Method: | X-RAY DIFFRACTION (1.95 Å) | | Cite: | Mechanistic study of SCOOPs recognition by MIK2-BAK1 complex reveals the role of N-glycans in plant ligand-receptor-coreceptor complex formation
Nature Plants, 2024
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8WEC
 | | Crystal structure of Arabidopsis thaliana MIK2 ectodomain in complex with BAK1 ectodomain and SCOOP12 | | Descriptor: | 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-[alpha-L-fucopyranose-(1-6)]2-acetamido-2-deoxy-beta-D-glucopyranose, ... | | Authors: | Wan, L.H, Hu, Y.X, Wu, H.M. | | Deposit date: | 2023-09-17 | | Release date: | 2024-11-06 | | Method: | X-RAY DIFFRACTION (3.1 Å) | | Cite: | Mechanistic study of SCOOPs recognition by MIK2-BAK1 complex reveals the role of N-glycans in plant ligand-receptor-coreceptor complex formation
Nature Plants, 2024
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8WED
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8WEE
 | | Crystal structure of Arabidopsis thaliana MIK2 ectodomain in complex with SCOOP12 | | Descriptor: | 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-[alpha-L-fucopyranose-(1-6)]2-acetamido-2-deoxy-beta-D-glucopyranose, ... | | Authors: | Wan, L.H, Hu, Y.X, Wu, H.M. | | Deposit date: | 2023-09-17 | | Release date: | 2024-11-06 | | Method: | X-RAY DIFFRACTION (2.19 Å) | | Cite: | Mechanistic study of SCOOPs recognition by MIK2-BAK1 complex reveals the role of N-glycans in plant ligand-receptor-coreceptor complex formation
Nature Plants, 2024
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8WEF
 | | Crystal structure of Brassica napus MIK2 ectodomain in complex with Fusarium oxysporum SCOOPL | | Descriptor: | 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-[alpha-L-fucopyranose-(1-6)]2-acetamido-2-deoxy-beta-D-glucopyranose, ... | | Authors: | Wan, L.H, Hu, Y.X, Wu, H.M. | | Deposit date: | 2023-09-17 | | Release date: | 2024-11-06 | | Method: | X-RAY DIFFRACTION (2.8 Å) | | Cite: | Mechanistic study of SCOOPs recognition by MIK2-BAK1 complex reveals the role of N-glycans in plant ligand-receptor-coreceptor complex formation
Nature Plants, 2024
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