5R9Z
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![BU of 5r9z by Molmil](/molmil-images/mine/5r9z) | |
5R9U
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![BU of 5r9u by Molmil](/molmil-images/mine/5r9u) | |
5R8Y
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![BU of 5r8y by Molmil](/molmil-images/mine/5r8y) | |
5RA9
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![BU of 5ra9 by Molmil](/molmil-images/mine/5ra9) | |
5R98
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![BU of 5r98 by Molmil](/molmil-images/mine/5r98) | |
5R9N
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![BU of 5r9n by Molmil](/molmil-images/mine/5r9n) | |
5R9D
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![BU of 5r9d by Molmil](/molmil-images/mine/5r9d) | |
5R9S
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![BU of 5r9s by Molmil](/molmil-images/mine/5r9s) | |
5R9X
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![BU of 5r9x by Molmil](/molmil-images/mine/5r9x) | |
5R9P
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![BU of 5r9p by Molmil](/molmil-images/mine/5r9p) | |
5R9G
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![BU of 5r9g by Molmil](/molmil-images/mine/5r9g) | PanDDA analysis group deposition Form1 MAP kinase p38-alpha -- Fragment PC587 in complex with MAP kinase p38-alpha | Descriptor: | (4R,4aS,7aS,9S)-3,10-dimethyl-5,6,7,7a,8,9-hexahydro-4H-4a,9-epiminopyrrolo[3',4':5,6]cyclohepta[1,2-d][1,2]oxazol-4-ol, CHLORIDE ION, DIMETHYL SULFOXIDE, ... | Authors: | De Nicola, G.F, Nichols, C.E. | Deposit date: | 2020-03-04 | Release date: | 2020-07-22 | Last modified: | 2024-03-06 | Method: | X-RAY DIFFRACTION (1.73 Å) | Cite: | Mining the PDB for Tractable Cases Where X-ray Crystallography Combined with Fragment Screens Can Be Used to Systematically Design Protein-Protein Inhibitors: Two Test Cases Illustrated by IL1 beta-IL1R and p38 alpha-TAB1 Complexes. J.Med.Chem., 63, 2020
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5R8X
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![BU of 5r8x by Molmil](/molmil-images/mine/5r8x) | |
5R91
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![BU of 5r91 by Molmil](/molmil-images/mine/5r91) | |
5R9C
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![BU of 5r9c by Molmil](/molmil-images/mine/5r9c) | |
5R9R
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![BU of 5r9r by Molmil](/molmil-images/mine/5r9r) | |
5R96
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![BU of 5r96 by Molmil](/molmil-images/mine/5r96) | |
5R9E
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![BU of 5r9e by Molmil](/molmil-images/mine/5r9e) | |
5RA8
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![BU of 5ra8 by Molmil](/molmil-images/mine/5ra8) | |
5R9T
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![BU of 5r9t by Molmil](/molmil-images/mine/5r9t) | PanDDA analysis group deposition Form1 MAP kinase p38-alpha -- Fragment N13477a in complex with MAP kinase p38-alpha | Descriptor: | 6-methyl-5-[(4-propan-2-ylphenyl)amino]-2~{H}-1,2,4-triazin-3-one, CHLORIDE ION, MAGNESIUM ION, ... | Authors: | De Nicola, G.F, Nichols, C.E. | Deposit date: | 2020-03-04 | Release date: | 2020-07-22 | Last modified: | 2024-03-06 | Method: | X-RAY DIFFRACTION (1.8 Å) | Cite: | Mining the PDB for Tractable Cases Where X-ray Crystallography Combined with Fragment Screens Can Be Used to Systematically Design Protein-Protein Inhibitors: Two Test Cases Illustrated by IL1 beta-IL1R and p38 alpha-TAB1 Complexes. J.Med.Chem., 63, 2020
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5R9M
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![BU of 5r9m by Molmil](/molmil-images/mine/5r9m) | |
5R9I
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![BU of 5r9i by Molmil](/molmil-images/mine/5r9i) | |
5RA6
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![BU of 5ra6 by Molmil](/molmil-images/mine/5ra6) | PanDDA analysis group deposition Form1 MAP kinase p38-alpha -- Fragment N11338a in complex with MAP kinase p38-alpha | Descriptor: | 1-[(1~{R},2~{R},4~{S})-2-bicyclo[2.2.1]heptanyl]-3-(2-pyridin-2-ylethyl)thiourea, CHLORIDE ION, DIMETHYL SULFOXIDE, ... | Authors: | De Nicola, G.F, Nichols, C.E. | Deposit date: | 2020-03-04 | Release date: | 2020-07-22 | Last modified: | 2024-03-06 | Method: | X-RAY DIFFRACTION (1.86 Å) | Cite: | Mining the PDB for Tractable Cases Where X-ray Crystallography Combined with Fragment Screens Can Be Used to Systematically Design Protein-Protein Inhibitors: Two Test Cases Illustrated by IL1 beta-IL1R and p38 alpha-TAB1 Complexes. J.Med.Chem., 63, 2020
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5R9W
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![BU of 5r9w by Molmil](/molmil-images/mine/5r9w) | |
5R99
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![BU of 5r99 by Molmil](/molmil-images/mine/5r99) | |
5RA0
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![BU of 5ra0 by Molmil](/molmil-images/mine/5ra0) | |