8QHV
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8QBR
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9B9Q
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9BD2
| MAGE-A3 MHD crystal soaked with KL861 | Descriptor: | (furan-2-yl)[4-({(5P)-5-(1H-indazol-4-yl)-2-[3-(morpholin-4-yl)propoxy]phenyl}methyl)piperazin-1-yl]methanone, Melanoma-associated antigen 3 | Authors: | Butrin, A, Krone, M.W, Li, K, Bond, M.J, Linhares, B.M, Crews, C. | Deposit date: | 2024-04-10 | Release date: | 2024-09-18 | Method: | X-RAY DIFFRACTION (2.24 Å) | Cite: | Development of Ligands and Degraders Targeting MAGE-A3. J.Am.Chem.Soc., 2024
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9FJ4
| Structure of ubiquitin bound to coiled coil-UIM form 1 | Descriptor: | 3-[1-(2-oxidanylideneethyl)-1,2,3-triazol-4-yl]propanal, GLU-GLN-GLU-ILE-GLU-GLU-LEU-GLU-ILE-GLU-ILE-ALA-ILE-LEU-LEU-SER-GLU-ILE-GLU-GLY, LYS-GLN-LYS-ILE-ALA-ALA-LEU-LYS-TYR-LYS-ILE-ALA-ALA-LEU-LYS-GLN-LYS-ILE-GLN, ... | Authors: | Paredes Vergara, P, Huang, D.T. | Deposit date: | 2024-05-30 | Release date: | 2024-09-18 | Method: | X-RAY DIFFRACTION (1.54 Å) | Cite: | An engineered ubiquitin binding coiled coil peptide Chem Sci, 2024
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9FJ3
| Structure of ubiquitin bound of coiled-coil UIM form 2 | Descriptor: | 3-[1-(2-oxidanylideneethyl)-1,2,3-triazol-4-yl]propanal, GLU-GLN-GLU-ILE-GLU-GLU-LEU-GLU-ILE-GLU-ILE-ALA-ILE-LEU-LEU-SER-GLU-ILE-GLU-GLY, LYS-GLN-LYS-ILE-ALA-ALA-LEU-LYS-TYR-LYS-ILE-ALA-ALA-LEU-LYS-GLN-LYS-ILE, ... | Authors: | Paredes Vergara, P, Huang, D.T. | Deposit date: | 2024-05-30 | Release date: | 2024-09-18 | Method: | X-RAY DIFFRACTION (1.4 Å) | Cite: | An engineered ubiquitin binding coiled coil peptide Chem Sci, 2024
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8IC5
| Respiratory complex CIII2, focus-refined of type I, PERK -/- mouse under cold temperature | Descriptor: | 1,2-Distearoyl-sn-glycerophosphoethanolamine, 5-(3,7,11,15,19,23-HEXAMETHYL-TETRACOSA-2,6,10,14,18,22-HEXAENYL)-2,3-DIMETHOXY-6-METHYL-BENZENE-1,4-DIOL, CARDIOLIPIN, ... | Authors: | Shin, Y.-C, Liao, M. | Deposit date: | 2023-02-10 | Release date: | 2024-09-18 | Method: | ELECTRON MICROSCOPY (4.1 Å) | Cite: | Respiratory complex CIII2, focus-refined of type I, PERK -/- mouse under cold temperature To Be Published
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8S7F
| Crystal structure of Escherichia coli LpxH in complex with EBL-2805 | Descriptor: | MANGANESE (II) ION, N-[4-[4-[3,5-bis(chloranyl)phenyl]piperazin-1-yl]sulfonylphenyl]-2-[methyl(methylsulfonyl)amino]benzamide, UDP-2,3-diacylglucosamine hydrolase | Authors: | Sooriyaarachchi, S, Mowbray, S.L, Bergfors, T, Jones, T.A. | Deposit date: | 2024-03-01 | Release date: | 2024-09-18 | Method: | X-RAY DIFFRACTION (1.6 Å) | Cite: | Design, synthesis, and in vitro biological evaluation of meta-sulfonamidobenzamide-based antibacterial LpxH inhibitors. Eur.J.Med.Chem., 278, 2024
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8ZYP
| Cryo-EM Structure of E-4031-bound hERG Channel | Descriptor: | Potassium voltage-gated channel subfamily H member 2, ~{N}-[4-[1-[2-(6-methylpyridin-2-yl)ethyl]piperidin-4-yl]carbonylphenyl]methanesulfonamide | Authors: | Miyashita, Y, Moriya, T, Kato, T, Kawasaki, M, Yasuda, Y, Adachi, N, Suzuki, K, Ogasawara, S, Saito, T, Senda, T, Murata, T. | Deposit date: | 2024-06-18 | Release date: | 2024-09-18 | Method: | ELECTRON MICROSCOPY (3.19 Å) | Cite: | Improved higher resolution Cryo-EM structures reveal the binding modes of hERG Channel Inhibitors To Be Published
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9B1G
| Human urate transporter 1 URAT1 in complex with dotinurad | Descriptor: | 2-acetamido-2-deoxy-beta-D-glucopyranose, Solute carrier family 22 member 12, dotinurad | Authors: | Dai, Y, Lee, C.H. | Deposit date: | 2024-03-13 | Release date: | 2024-09-18 | Method: | ELECTRON MICROSCOPY (2.7 Å) | Cite: | Transport mechanism and structural pharmacology of human urate transporter URAT1. Cell Res., 2024
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9B1H
| Human urate transporter 1 URAT1 in complex with lesinurad | Descriptor: | 2-acetamido-2-deoxy-beta-D-glucopyranose, Solute carrier family 22 member 12, lesinurad | Authors: | Dai, Y, Lee, C.H. | Deposit date: | 2024-03-13 | Release date: | 2024-09-18 | Method: | ELECTRON MICROSCOPY (2.9 Å) | Cite: | Transport mechanism and structural pharmacology of human urate transporter URAT1. Cell Res., 2024
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9B1I
| Human urate transporter 1 URAT1 in complex with verinurad | Descriptor: | 2-acetamido-2-deoxy-beta-D-glucopyranose, Solute carrier family 22 member 12, verinurad | Authors: | Dai, Y, Lee, C.H. | Deposit date: | 2024-03-13 | Release date: | 2024-09-18 | Method: | ELECTRON MICROSCOPY (3.7 Å) | Cite: | Transport mechanism and structural pharmacology of human urate transporter URAT1. Cell Res., 2024
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8WD7
| Structural organization of the palisade layer in isolated vaccinia virus cores | Descriptor: | Core protein OPG136 | Authors: | Liu, Y, Qu, X, Duan, M, Shi, X, Liu, S, Shi, Y, Gao, G.F. | Deposit date: | 2023-09-14 | Release date: | 2024-09-18 | Method: | ELECTRON MICROSCOPY (10 Å) | Cite: | Cryo-ET reveals A10 protein as a major component of the poxvirus palisade layer To Be Published
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8WDC
| Structural organization of the palisade layer in intracellular mature vaccinia virions | Descriptor: | Core protein OPG136 | Authors: | Liu, Y, Qu, X, Duan, M, Shi, X, Liu, S, Shi, Y, Gao, G.F. | Deposit date: | 2023-09-14 | Release date: | 2024-09-18 | Method: | ELECTRON MICROSCOPY (7.7 Å) | Cite: | Cryo-ET reveals A10 protein as a major component of the poxvirus palisade layer To Be Published
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8IB7
| Respiratory complex CIII2, focus-refined of type IA, Wild type mouse under cold temperature | Descriptor: | 1,2-DIACYL-GLYCEROL-3-SN-PHOSPHATE, 1,2-Distearoyl-sn-glycerophosphoethanolamine, 5-(3,7,11,15,19,23-HEXAMETHYL-TETRACOSA-2,6,10,14,18,22-HEXAENYL)-2,3-DIMETHOXY-6-METHYL-BENZENE-1,4-DIOL, ... | Authors: | Shin, Y.-C, Liao, M. | Deposit date: | 2023-02-09 | Release date: | 2024-09-18 | Method: | ELECTRON MICROSCOPY (3.4 Å) | Cite: | Respiratory complex CIII2, focus-refined of type IA, Wild type mouse under cold temperature To Be Published
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9CGN
| Pikromycin Thioesterase with heptaketide adduct | Descriptor: | (2S,4R,5S,6S,8R,12R,13R)-5,13-dihydroxy-2,4,6,8,12-pentamethyl-3,9-dioxopentadecanal, Narbonolide/10-deoxymethynolide synthase PikA4, module 6 | Authors: | Smith, J.L, Choudhary, V. | Deposit date: | 2024-06-30 | Release date: | 2024-09-18 | Method: | X-RAY DIFFRACTION (2.8 Å) | Cite: | Substrate Trapping in Polyketide Synthase Thioesterase Domains: Structural Basis for Macrolactone Formation Acs Catalysis, 14, 2024
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9CGL
| Pikromycin Thioesterase Doubly Protected DAP | Descriptor: | 2-{[(1R)-1-(6-nitro-2H-1,3-benzodioxol-5-yl)ethyl]sulfanyl}ethyl formate, Narbonolide/10-deoxymethynolide synthase PikA4, module 6 | Authors: | McCullough, T.M, Smith, J.L. | Deposit date: | 2024-06-29 | Release date: | 2024-09-18 | Method: | X-RAY DIFFRACTION (3.1 Å) | Cite: | Substrate Trapping in Polyketide Synthase Thioesterase Domains: Structural Basis for Macrolactone Formation Acs Catalysis, 14, 2024
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9CIH
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9CJ9
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9ENG
| Structure of K.pneumoniae LpxH in complex with EBL-3218 | Descriptor: | MANGANESE (II) ION, UDP-2,3-diacylglucosamine hydrolase, ~{N}-[4-[4-[3,5-bis(chloranyl)phenyl]piperazin-1-yl]sulfonylphenyl]-3-(methylsulfonylamino)benzamide | Authors: | Sooriyaarachchi, S, Bergfors, T, Jones, T.A, Mowbray, S.L. | Deposit date: | 2024-03-12 | Release date: | 2024-09-18 | Method: | X-RAY DIFFRACTION (2.2 Å) | Cite: | Design, synthesis, and in vitro biological evaluation of meta-sulfonamidobenzamide-based antibacterial LpxH inhibitors. Eur.J.Med.Chem., 278, 2024
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9C4M
| Crystal Structure of A. baumannii GuaB dCBS with inhibitor G6 (3826) | Descriptor: | INOSINIC ACID, Inosine-5'-monophosphate dehydrogenase, N-[4-chloro-3-(morpholin-4-yl)phenyl]-N~2~-[3-(hydroxymethyl)quinolin-6-yl]-L-alaninamide | Authors: | Harris, S.F, Wu, P. | Deposit date: | 2024-06-04 | Release date: | 2024-09-18 | Method: | X-RAY DIFFRACTION (2.48 Å) | Cite: | Differential effects of inosine monophosphate dehydrogenase (IMPDH/GuaB) inhibition in Acinetobacter baumannii and Escherichia coli. J.Bacteriol., 2024
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9CE4
| Structure of CHK1 10-pt. mutant complex with LRRK2 indazole inhibitor compound 6 | Descriptor: | (1S,4r)-4-[(1P)-5-chloro-1-(1-methyl-1H-pyrazol-4-yl)-1H-indazol-6-yl]-1-(oxetan-3-yl)piperidin-1-ium, 1,2-ETHANEDIOL, Serine/threonine-protein kinase Chk1 | Authors: | Palte, R.L, Zebisch, M, Henry, C, Barker, J.J. | Deposit date: | 2024-06-26 | Release date: | 2024-09-18 | Method: | X-RAY DIFFRACTION (1.31 Å) | Cite: | Discovery and Optimization of N-Heteroaryl Indazole LRRK2 Inhibitors. J.Med.Chem., 2024
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8CQW
| Crystal structure of the Candida albicans 80S ribosome in complex with Hygromycin B | Descriptor: | 18S, 25S, 3-O-acetyl-2-O-(3-O-acetyl-6-deoxy-beta-D-glucopyranosyl)-6-deoxy-1-O-{[(2R,2'S,3a'R,4''S,5''R,6'S,7a'S)-5''-methyl-4''-{[(2E)-3-phenylprop-2-enoyl]oxy}decahydrodispiro[oxirane-2,3'-[1]benzofuran-2',2''-pyran]-6'-yl]carbonyl}-beta-D-glucopyranose, ... | Authors: | Kolosova, O, Zgadzay, Y, Yusupov, M. | Deposit date: | 2023-03-07 | Release date: | 2024-09-18 | Method: | X-RAY DIFFRACTION (3.05 Å) | Cite: | Drug-induced rotational movement of the ribosome is a key factor for read-through enhancement To Be Published
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8CRE
| Crystal structure of the Candida albicans 80S ribosome in complex with geneticin G418 | Descriptor: | 18S, 25S, 3-O-acetyl-2-O-(3-O-acetyl-6-deoxy-beta-D-glucopyranosyl)-6-deoxy-1-O-{[(2R,2'S,3a'R,4''S,5''R,6'S,7a'S)-5''-methyl-4''-{[(2E)-3-phenylprop-2-enoyl]oxy}decahydrodispiro[oxirane-2,3'-[1]benzofuran-2',2''-pyran]-6'-yl]carbonyl}-beta-D-glucopyranose, ... | Authors: | Kolosova, O, Zgadzay, Y, Yusupov, M. | Deposit date: | 2023-03-08 | Release date: | 2024-09-18 | Method: | X-RAY DIFFRACTION (3 Å) | Cite: | Drug-induced rotational movement of the ribosome is a key factor for read-through enhancement To Be Published
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8IBC
| Respiratory complex CIII2, focus-refined of type IB, Wild type mouse under cold temperature | Descriptor: | 1,2-Distearoyl-sn-glycerophosphoethanolamine, 5-(3,7,11,15,19,23-HEXAMETHYL-TETRACOSA-2,6,10,14,18,22-HEXAENYL)-2,3-DIMETHOXY-6-METHYL-BENZENE-1,4-DIOL, CARDIOLIPIN, ... | Authors: | Shin, Y.-C, Liao, M. | Deposit date: | 2023-02-10 | Release date: | 2024-09-18 | Method: | ELECTRON MICROSCOPY (3.6 Å) | Cite: | Respiratory complex CIII2, focus-refined of type IB, Wild type mouse under cold temperature To Be Published
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