7TWR
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![BU of 7twr by Molmil](/molmil-images/mine/7twr) | |
7TWQ
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![BU of 7twq by Molmil](/molmil-images/mine/7twq) | |
7TWP
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![BU of 7twp by Molmil](/molmil-images/mine/7twp) | |
7TWI
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![BU of 7twi by Molmil](/molmil-images/mine/7twi) | |
7TWG
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![BU of 7twg by Molmil](/molmil-images/mine/7twg) | |
7TWS
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![BU of 7tws by Molmil](/molmil-images/mine/7tws) | |
7TWJ
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![BU of 7twj by Molmil](/molmil-images/mine/7twj) | |
7TWH
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![BU of 7twh by Molmil](/molmil-images/mine/7twh) | |
7TX3
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![BU of 7tx3 by Molmil](/molmil-images/mine/7tx3) | |
7TWN
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![BU of 7twn by Molmil](/molmil-images/mine/7twn) | |
7TWO
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![BU of 7two by Molmil](/molmil-images/mine/7two) | |
5SQ0
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![BU of 5sq0 by Molmil](/molmil-images/mine/5sq0) | |
5SPZ
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![BU of 5spz by Molmil](/molmil-images/mine/5spz) | |
5SPX
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![BU of 5spx by Molmil](/molmil-images/mine/5spx) | |
5SQ1
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![BU of 5sq1 by Molmil](/molmil-images/mine/5sq1) | |
5SQ2
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5SQ3
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![BU of 5sq3 by Molmil](/molmil-images/mine/5sq3) | |
5SPY
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![BU of 5spy by Molmil](/molmil-images/mine/5spy) | |
5SQ4
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![BU of 5sq4 by Molmil](/molmil-images/mine/5sq4) | |
5SQ8
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![BU of 5sq8 by Molmil](/molmil-images/mine/5sq8) | |
5SQB
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![BU of 5sqb by Molmil](/molmil-images/mine/5sqb) | PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with Z5010894390 - (R,R) and (S,S) isomers | Descriptor: | (1R,2R)-1-({6-[(cyclopropylmethyl)amino]pyridine-3-carbonyl}amino)-4-hydroxy-2,3-dihydro-1H-indene-2-carboxylic acid, (1S,2S)-1-({6-[(cyclopropylmethyl)amino]pyridine-3-carbonyl}amino)-4-hydroxy-2,3-dihydro-1H-indene-2-carboxylic acid, Non-structural protein 3 | Authors: | Correy, G.J, Fraser, J.S. | Deposit date: | 2022-06-09 | Release date: | 2022-07-06 | Last modified: | 2023-09-20 | Method: | X-RAY DIFFRACTION (1.05 Å) | Cite: | Iterative computational design and crystallographic screening identifies potent inhibitors targeting the Nsp3 macrodomain of SARS-CoV-2. Proc.Natl.Acad.Sci.USA, 120, 2023
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5SQC
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![BU of 5sqc by Molmil](/molmil-images/mine/5sqc) | PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with Z5010894388 - (R,R) and (S,S) isomers | Descriptor: | (1R,2R)-4-hydroxy-1-({5-[(oxan-4-yl)amino]pyrazine-2-carbonyl}amino)-2,3-dihydro-1H-indene-2-carboxylic acid, (1S,2S)-4-hydroxy-1-({5-[(oxan-4-yl)amino]pyrazine-2-carbonyl}amino)-2,3-dihydro-1H-indene-2-carboxylic acid, Non-structural protein 3 | Authors: | Correy, G.J, Fraser, J.S. | Deposit date: | 2022-06-09 | Release date: | 2022-07-06 | Last modified: | 2023-09-20 | Method: | X-RAY DIFFRACTION (1.05 Å) | Cite: | Iterative computational design and crystallographic screening identifies potent inhibitors targeting the Nsp3 macrodomain of SARS-CoV-2. Proc.Natl.Acad.Sci.USA, 120, 2023
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5SQ6
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5SPM
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![BU of 5spm by Molmil](/molmil-images/mine/5spm) | PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with FRESH00002410346 | Descriptor: | 4-hydroxy-6-(3-hydroxy-1-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-c]pyridine-6-carbonyl)-2H-pyran-2-one, Non-structural protein 3 | Authors: | Correy, G.J, Fraser, J.S. | Deposit date: | 2022-06-09 | Release date: | 2022-07-13 | Last modified: | 2023-09-20 | Method: | X-RAY DIFFRACTION (1.05 Å) | Cite: | Iterative computational design and crystallographic screening identifies potent inhibitors targeting the Nsp3 macrodomain of SARS-CoV-2. Proc.Natl.Acad.Sci.USA, 120, 2023
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5SPO
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![BU of 5spo by Molmil](/molmil-images/mine/5spo) | |