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PDB: 5 件

8TV6
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BU of 8tv6 by Molmil
SARS-CoV-2 Mac1 in complex with MDOLL-0169
分子名称: (1R,6R)-6-{[3-(methoxycarbonyl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl]carbamoyl}cyclohex-3-ene-1-carboxylic acid, DI(HYDROXYETHYL)ETHER, GLYCEROL, ...
著者Wazir, S, Maksimainen, M, Lehtio, L.
登録日2023-08-17
公開日2024-04-17
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (1.74 Å)
主引用文献Discovery of 2-Amide-3-methylester Thiophenes that Target SARS-CoV-2 Mac1 and Repress Coronavirus Replication, Validating Mac1 as an Antiviral Target.
J.Med.Chem., 67, 2024
8TV7
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BU of 8tv7 by Molmil
SARS-CoV-2 Mac1 in complex with MDOLL-0229
分子名称: (1R,2R)-2-{[3-(methoxycarbonyl)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl]carbamoyl}cyclohexane-1-carboxylic acid, GLYCEROL, Papain-like protease nsp3
著者Wazir, S, Maksimainen, M, Lehtio, L.
登録日2023-08-17
公開日2024-04-24
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (1.5 Å)
主引用文献Discovery of 2-Amide-3-methylester Thiophenes that Target SARS-CoV-2 Mac1 and Repress Coronavirus Replication, Validating Mac1 as an Antiviral Target.
J.Med.Chem., 67, 2024
6Y73
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BU of 6y73 by Molmil
The crystal structure of human MACROD2 in space group P43
分子名称: ADP-ribose glycohydrolase MACROD2, DIMETHYL SULFOXIDE, GLYCEROL, ...
著者Wazir, S, Maksimainen, M.M, Lehtio, L.
登録日2020-02-28
公開日2020-09-30
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (1.7 Å)
主引用文献Multiple crystal forms of human MacroD2.
Acta Crystallogr.,Sect.F, 76, 2020
6Y4Z
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BU of 6y4z by Molmil
The crystal structure of human MACROD2 in space group P43212
分子名称: L(+)-TARTARIC ACID, Thioredoxin 1,ADP-ribose glycohydrolase MACROD2
著者Wazir, S, Maksimainen, M.M, Lehtio, L.
登録日2020-02-24
公開日2020-09-30
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Multiple crystal forms of human MacroD2.
Acta Crystallogr.,Sect.F, 76, 2020
6Y4Y
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BU of 6y4y by Molmil
The crystal structure of human MACROD2 in space group P41212
分子名称: L(+)-TARTARIC ACID, Thioredoxin 1,ADP-ribose glycohydrolase MACROD2
著者Wazir, S, Maksimainen, M.M, Lehtio, L.
登録日2020-02-24
公開日2020-09-30
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (1.75 Å)
主引用文献Multiple crystal forms of human MacroD2.
Acta Crystallogr.,Sect.F, 76, 2020

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件を2024-05-15に公開中

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