5R9J
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![BU of 5r9j by Molmil](/molmil-images/mine/5r9j) | PanDDA analysis group deposition Form1 MAP kinase p38-alpha -- Fragment N14231a in complex with MAP kinase p38-alpha | Descriptor: | 3-ethyl-1-[(1~{R},8~{S},9~{S},10~{S})-10-oxidanyl-11-oxatricyclo[6.2.1.0^{2,7}]undeca-2(7),3,5-trien-9-yl]imidazolidine-2,4-dione, 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 (1.52 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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5R9K
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5R9L
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![BU of 5r9l by Molmil](/molmil-images/mine/5r9l) | |
5R9M
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![BU of 5r9m by Molmil](/molmil-images/mine/5r9m) | |
5R9N
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![BU of 5r9n by Molmil](/molmil-images/mine/5r9n) | |
5R9O
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![BU of 5r9o by Molmil](/molmil-images/mine/5r9o) | |
5R9P
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![BU of 5r9p by Molmil](/molmil-images/mine/5r9p) | |
5R9Q
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![BU of 5r9q by Molmil](/molmil-images/mine/5r9q) | |
5R9R
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![BU of 5r9r by Molmil](/molmil-images/mine/5r9r) | |
5R9S
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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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5R9U
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5R9V
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5R9W
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![BU of 5r9w by Molmil](/molmil-images/mine/5r9w) | |
5R9X
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5R9Y
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5R9Z
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5RA0
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![BU of 5ra0 by Molmil](/molmil-images/mine/5ra0) | |
5RA1
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![BU of 5ra1 by Molmil](/molmil-images/mine/5ra1) | |
5RA2
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![BU of 5ra2 by Molmil](/molmil-images/mine/5ra2) | |
5RA3
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![BU of 5ra3 by Molmil](/molmil-images/mine/5ra3) | |
5RA4
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![BU of 5ra4 by Molmil](/molmil-images/mine/5ra4) | |
5RA5
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![BU of 5ra5 by Molmil](/molmil-images/mine/5ra5) | |
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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5RA7
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![BU of 5ra7 by Molmil](/molmil-images/mine/5ra7) | |