7D24
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![BU of 7d24 by Molmil](/molmil-images/mine/7d24) | Hsp90 alpha N-terminal domain in complex with a 4B compund | Descriptor: | 9-[(3-tert-butyl-1,2-oxazol-5-yl)methyl]-6-chloranyl-purin-2-amine, Heat shock protein HSP 90-alpha | Authors: | Shin, S.C, Kim, E.E. | Deposit date: | 2020-09-15 | Release date: | 2021-07-28 | Last modified: | 2023-11-29 | Method: | X-RAY DIFFRACTION (1.55 Å) | Cite: | Structural Basis for Design of New Purine-Based Inhibitors Targeting the Hydrophobic Binding Pocket of Hsp90. Int J Mol Sci, 21, 2020
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7D26
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![BU of 7d26 by Molmil](/molmil-images/mine/7d26) | Hsp90 alpha N-terminal domain in complex with a 8 compund | Descriptor: | 6-chloranyl-9-[(2-phenyl-1,3-oxazol-5-yl)methyl]purin-2-amine, Heat shock protein HSP 90-alpha | Authors: | Shin, S.C, Kim, E.E. | Deposit date: | 2020-09-15 | Release date: | 2021-07-28 | Last modified: | 2023-11-29 | Method: | X-RAY DIFFRACTION (1.75 Å) | Cite: | Structural Basis for Design of New Purine-Based Inhibitors Targeting the Hydrophobic Binding Pocket of Hsp90. Int J Mol Sci, 21, 2020
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7D22
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![BU of 7d22 by Molmil](/molmil-images/mine/7d22) | Hsp90 alpha N-terminal domain in complex with a 6B compund | Descriptor: | 9-[(3-tert-butyl-1,2-oxazol-5-yl)methyl]-6-chloranyl-purin-2-amine, Heat shock protein HSP 90-alpha | Authors: | Shin, S.C, Kim, E.E. | Deposit date: | 2020-09-15 | Release date: | 2021-07-28 | Last modified: | 2023-11-29 | Method: | X-RAY DIFFRACTION (1.6 Å) | Cite: | Structural Basis for Design of New Purine-Based Inhibitors Targeting the Hydrophobic Binding Pocket of Hsp90. Int J Mol Sci, 21, 2020
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7D1V
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![BU of 7d1v by Molmil](/molmil-images/mine/7d1v) | Hsp90 alpha N-terminal domain in complex with a 6C compund | Descriptor: | 6-chloranyl-9-[(3-propan-2-yl-1,2-oxazol-5-yl)methyl]purin-2-amine, Heat shock protein HSP 90-alpha | Authors: | Shin, S.C, Kim, E.E. | Deposit date: | 2020-09-15 | Release date: | 2021-07-28 | Last modified: | 2023-11-29 | Method: | X-RAY DIFFRACTION (1.332 Å) | Cite: | Structural Basis for Design of New Purine-Based Inhibitors Targeting the Hydrophobic Binding Pocket of Hsp90. Int J Mol Sci, 21, 2020
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7D25
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![BU of 7d25 by Molmil](/molmil-images/mine/7d25) | Hsp90 alpha N-terminal domain in complex with a 14 compund | Descriptor: | 6-chloranyl-9-[(4-methylphenyl)methyl]purin-2-amine, Heat shock protein HSP 90-alpha | Authors: | Shin, S.C, Kim, E.E. | Deposit date: | 2020-09-15 | Release date: | 2021-07-28 | Last modified: | 2023-11-29 | Method: | X-RAY DIFFRACTION (1.65 Å) | Cite: | Structural Basis for Design of New Purine-Based Inhibitors Targeting the Hydrophobic Binding Pocket of Hsp90. Int J Mol Sci, 21, 2020
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8ITP
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![BU of 8itp by Molmil](/molmil-images/mine/8itp) | |
8ITN
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![BU of 8itn by Molmil](/molmil-images/mine/8itn) | Crystal structure of USP47apo catalytic domain | Descriptor: | Ubiquitin carboxyl-terminal hydrolase 47, ZINC ION | Authors: | Kim, E.E, Shin, S.C. | Deposit date: | 2023-03-22 | Release date: | 2024-03-27 | Last modified: | 2024-05-08 | Method: | X-RAY DIFFRACTION (2.6 Å) | Cite: | Structural and functional characterization of USP47 reveals a hot spot for inhibitor design. Commun Biol, 6, 2023
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5ZQM
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5ZQL
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7FGN
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![BU of 7fgn by Molmil](/molmil-images/mine/7fgn) | The crystal structure of the FAF1 UBL1 | Descriptor: | FAS-associated factor 1 | Authors: | Kim, E.E, ParK, J.K, Shin, S.C. | Deposit date: | 2021-07-27 | Release date: | 2022-07-27 | Last modified: | 2024-05-29 | Method: | X-RAY DIFFRACTION (1.199 Å) | Cite: | The complex of Fas-associated factor 1 with Hsp70 stabilizes the adherens junction integrity by suppressing RhoA activation J Mol Cell Biol, 14, 2022
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7FGM
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![BU of 7fgm by Molmil](/molmil-images/mine/7fgm) | The complex crystals structure of the FAF1 UBL1_L-Hsp70 NBD with ADP and phosphate | Descriptor: | ADENOSINE-5'-DIPHOSPHATE, FAS-associated factor 1, Heat shock 70 kDa protein 1A, ... | Authors: | Kim, E.E, ParK, J.K, Shin, S.C. | Deposit date: | 2021-07-27 | Release date: | 2022-07-27 | Last modified: | 2023-11-29 | Method: | X-RAY DIFFRACTION (2.2 Å) | Cite: | The complex of Fas-associated factor 1 with Hsp70 stabilizes the adherens junction integrity by suppressing RhoA activation J Mol Cell Biol, 14, 2022
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5GVJ
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![BU of 5gvj by Molmil](/molmil-images/mine/5gvj) | Structure of FabK (M276A) mutant from Thermotoga maritima | Descriptor: | Enoyl-[acyl-carrier-protein] reductase [FMN], SODIUM ION | Authors: | Kim, E.E, Shin, S.C, Ha, B.H, Moon, J.H. | Deposit date: | 2016-09-06 | Release date: | 2017-04-26 | Last modified: | 2023-11-08 | Method: | X-RAY DIFFRACTION (1.9 Å) | Cite: | Structural and biochemical characterization of FabK from Thermotoga maritima. Biochem. Biophys. Res. Commun., 482, 2017
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5GVH
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![BU of 5gvh by Molmil](/molmil-images/mine/5gvh) | Structure of FabK from Thermotoga maritima | Descriptor: | Enoyl-[acyl-carrier-protein] reductase [FMN], FLAVIN MONONUCLEOTIDE, SODIUM ION | Authors: | Kim, E.E, Shin, S.C, Ha, B.H, Moon, J.H. | Deposit date: | 2016-09-05 | Release date: | 2017-06-07 | Last modified: | 2024-03-20 | Method: | X-RAY DIFFRACTION (2.294 Å) | Cite: | Structural and biochemical characterization of FabK from Thermotoga maritima. Biochem. Biophys. Res. Commun., 482, 2017
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5H22
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![BU of 5h22 by Molmil](/molmil-images/mine/5h22) | Hsp90 alpha N-terminal domain in complex with an inhibitor | Descriptor: | 4-chloranyl-7-[(4-methoxy-3,5-dimethyl-pyridin-2-yl)methyl]-5-(phenylmethyl)pyrrolo[2,3-d]pyrimidin-2-amine, Hsp90aa1 protein | Authors: | Kim, E.E, Shin, S.C, Keum, G.C. | Deposit date: | 2016-10-13 | Release date: | 2017-10-11 | Last modified: | 2023-11-08 | Method: | X-RAY DIFFRACTION (1.499 Å) | Cite: | Synthesis and in vitro antiproliferative activity of C5-benzyl substituted 2-amino-pyrrolo[2,3-d]pyrimidines as potent Hsp90 inhibitors. Bioorg. Med. Chem. Lett., 27, 2017
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5X3S
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7TBA
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![BU of 7tba by Molmil](/molmil-images/mine/7tba) | Pentraxin - ligand complex | Descriptor: | C-reactive protein, CALCIUM ION, [3-(dibutylamino)propyl]phosphonic acid | Authors: | Shing, K.S.C.T, Morton, C.J, Parker, M.W. | Deposit date: | 2021-12-21 | Release date: | 2022-10-19 | Last modified: | 2023-10-25 | Method: | X-RAY DIFFRACTION (3.5 Å) | Cite: | A novel phosphocholine-mimetic inhibits a pro-inflammatory conformational change in C-reactive protein. Embo Mol Med, 15, 2023
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7YC0
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![BU of 7yc0 by Molmil](/molmil-images/mine/7yc0) | Acetylesterase (LgEstI) W.T. | Descriptor: | ACETATE ION, Alpha/beta hydrolase, CHLORIDE ION | Authors: | Do, H, Lee, J.H. | Deposit date: | 2022-06-30 | Release date: | 2023-06-07 | Last modified: | 2024-04-03 | Method: | X-RAY DIFFRACTION (2 Å) | Cite: | Crystal structure and biochemical analysis of acetylesterase (LgEstI) from Lactococcus garvieae. Plos One, 18, 2023
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7YC4
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![BU of 7yc4 by Molmil](/molmil-images/mine/7yc4) | Acetylesterase (LgEstI) F207A | Descriptor: | Alpha/beta hydrolase | Authors: | Do, H, Lee, J.H. | Deposit date: | 2022-06-30 | Release date: | 2023-06-07 | Last modified: | 2023-11-29 | Method: | X-RAY DIFFRACTION (2.1 Å) | Cite: | Crystal structure and biochemical analysis of acetylesterase (LgEstI) from Lactococcus garvieae. Plos One, 18, 2023
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6LVP
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6LVO
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7DVN
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![BU of 7dvn by Molmil](/molmil-images/mine/7dvn) | Crystal structure of a MarR family protein in complex with a lipid-like effector molecule from the psychrophilic bacterium Paenisporosarcina sp. TG-14 | Descriptor: | MarR family transcriptional regulator, PALMITIC ACID | Authors: | Lee, C.W, Hwang, J, Do, H, Lee, J.H. | Deposit date: | 2021-01-14 | Release date: | 2021-11-24 | Last modified: | 2024-05-29 | Method: | X-RAY DIFFRACTION (1.6 Å) | Cite: | Crystal structure of a MarR family protein from the psychrophilic bacterium Paenisporosarcina sp. TG-14 in complex with a lipid-like molecule. Iucrj, 8, 2021
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6IYM
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5JCL
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![BU of 5jcl by Molmil](/molmil-images/mine/5jcl) | Structure and catalytic mechanism of monodehydroascorbate reductase, MDHAR, from Oryza sativa L. japonica | Descriptor: | FLAVIN-ADENINE DINUCLEOTIDE, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, Os09g0567300 protein | Authors: | Park, A.K, Kim, H.W. | Deposit date: | 2016-04-15 | Release date: | 2016-10-12 | Last modified: | 2023-11-08 | Method: | X-RAY DIFFRACTION (1.8 Å) | Cite: | Structure and catalytic mechanism of monodehydroascorbate reductase, MDHAR, from Oryza sativa L. japonica Sci Rep, 6, 2016
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5JCI
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![BU of 5jci by Molmil](/molmil-images/mine/5jci) | Structure and catalytic mechanism of monodehydroascorbate reductase, MDHAR, from Oryza sativa L. japonica | Descriptor: | FLAVIN-ADENINE DINUCLEOTIDE, Os09g0567300 protein | Authors: | Park, A.K, Kim, H.W. | Deposit date: | 2016-04-15 | Release date: | 2016-10-12 | Last modified: | 2024-03-20 | Method: | X-RAY DIFFRACTION (1.7 Å) | Cite: | Structure and catalytic mechanism of monodehydroascorbate reductase, MDHAR, from Oryza sativa L. japonica Sci Rep, 6, 2016
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5JCM
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![BU of 5jcm by Molmil](/molmil-images/mine/5jcm) | Structure and catalytic mechanism of monodehydroascorbate reductase, MDHAR, from Oryza sativa L. japonica | Descriptor: | FLAVIN-ADENINE DINUCLEOTIDE, ISOASCORBIC ACID, NICOTINAMIDE-ADENINE-DINUCLEOTIDE, ... | Authors: | Park, A.K, Kim, H.W. | Deposit date: | 2016-04-15 | Release date: | 2016-10-12 | Last modified: | 2023-11-08 | Method: | X-RAY DIFFRACTION (1.9 Å) | Cite: | Structure and catalytic mechanism of monodehydroascorbate reductase, MDHAR, from Oryza sativa L. japonica Sci Rep, 6, 2016
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