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6G78
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BU of 6g78 by Molmil
RSK4 N-terminal Kinase Domain S232E in complex with AMP-PNP
分子名称: PHOSPHOAMINOPHOSPHONIC ACID-ADENYLATE ESTER, Ribosomal protein S6 kinase alpha-6
著者Prischi, F, Ali, M.M.
登録日2018-04-04
公開日2019-04-17
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Repurposed floxacins targeting RSK4 prevent chemoresistance and metastasis in lung and bladder cancer.
Sci Transl Med, 13, 2021
6G77
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BU of 6g77 by Molmil
RSK4 N-terminal Kinase Domain in complex with AMP-PNP
分子名称: PHOSPHOAMINOPHOSPHONIC ACID-ADENYLATE ESTER, Ribosomal protein S6 kinase alpha-6, ZINC ION
著者Prischi, F, Ali, M.M.
登録日2018-04-04
公開日2019-04-17
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (2.499 Å)
主引用文献Repurposed floxacins targeting RSK4 prevent chemoresistance and metastasis in lung and bladder cancer.
Sci Transl Med, 13, 2021
6G76
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BU of 6g76 by Molmil
Phosphorylated RSK4 N-terminal Kinase Domain in complex with AMP-PNP
分子名称: PHOSPHOAMINOPHOSPHONIC ACID-ADENYLATE ESTER, Ribosomal protein S6 kinase alpha-6, ZINC ION
著者Prischi, F, Ali, M.M.
登録日2018-04-04
公開日2019-04-17
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (3 Å)
主引用文献Repurposed floxacins targeting RSK4 prevent chemoresistance and metastasis in lung and bladder cancer.
Sci Transl Med, 13, 2021
8RZV
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BU of 8rzv by Molmil
Structure of UP1 S4ES6E phosphomimetic mutant in complex with human telomeric repeat DNA
分子名称: DNA (5'-D(P*TP*AP*GP*GP*GP*TP*TP*AP*GP*GP*G)-3'), Heterogeneous nuclear ribonucleoprotein A1, N-terminally processed
著者Dunnett, L, Prischi, F.
登録日2024-02-13
公開日2024-03-13
実験手法X-RAY DIFFRACTION (1.51 Å)
主引用文献Structure of UP1 S4ES6E phosphomimetic mutant in complex with human telomeric repeat DNA
To Be Published
4YZS
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BU of 4yzs by Molmil
Crystal structures reveal transient PERK luminal domain tetramerization in ER stress signaling
分子名称: Eukaryotic translation initiation factor 2-alpha kinase 3, TUNGSTEN ION
著者Carrara, M, Prischi, F, Ali, M.M.U.
登録日2015-03-25
公開日2015-05-13
最終更新日2017-09-13
実験手法X-RAY DIFFRACTION (3.14 Å)
主引用文献Crystal structures reveal transient PERK luminal domain tetramerization in endoplasmic reticulum stress signaling.
Embo J., 34, 2015
4YZY
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BU of 4yzy by Molmil
Crystal structures reveal transient PERK luminal domain tetramerization in ER stress signaling
分子名称: Eukaryotic translation initiation factor 2-alpha kinase 3
著者Carrara, M, Prischi, F, Ali, M.M.U.
登録日2015-03-25
公開日2015-05-13
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (3.2 Å)
主引用文献Crystal structures reveal transient PERK luminal domain tetramerization in endoplasmic reticulum stress signaling.
Embo J., 34, 2015
9F7F
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BU of 9f7f by Molmil
UP1 in complex with Z1491353358
分子名称: (3S)-1-(phenylsulfonyl)pyrrolidin-3-amine, Heterogeneous nuclear ribonucleoprotein A1, N-terminally processed
著者Dunnett, L, Prischi, F.
登録日2024-05-03
公開日2024-05-15
実験手法X-RAY DIFFRACTION (1.55 Å)
主引用文献Enhanced identification of small molecules binding to hnRNP A1 via in silico hotspot and cryptic pockets mapping coupled with X-Ray fragment screening
To Be Published
9F4J
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BU of 9f4j by Molmil
UP1 in complex with Z416341642
分子名称: (2R)-N,2-dimethyl-N-(propan-2-yl)morpholine-4-sulfonamide, Heterogeneous nuclear ribonucleoprotein A1, N-terminally processed
著者Dunnett, L, Prischi, F.
登録日2024-04-28
公開日2024-05-08
実験手法X-RAY DIFFRACTION (1.4 Å)
主引用文献Enhanced identification of small molecules binding to hnRNP A1 via in silico hotspot and cryptic pockets mapping coupled with X-Ray fragment screening
To Be Published
9F4Q
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BU of 9f4q by Molmil
UP1 in complex with Z641239276
分子名称: 5-(2-phenylethylamino)pyrimidine-2,4-diol, Heterogeneous nuclear ribonucleoprotein A1, N-terminally processed
著者Dunnett, L, Prischi, F.
登録日2024-04-28
公開日2024-05-08
実験手法X-RAY DIFFRACTION (1.4 Å)
主引用文献Enhanced identification of small molecules binding to hnRNP A1 via in silico hotspot and cryptic pockets mapping coupled with X-Ray fragment screening
To Be Published
9F4X
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BU of 9f4x by Molmil
UP1 in complex with Z1220452176
分子名称: Heterogeneous nuclear ribonucleoprotein A1, N-terminally processed, ~{N}-[2-(5-fluoranyl-1~{H}-indol-3-yl)ethyl]ethanamide
著者Dunnett, L, Prischi, F.
登録日2024-04-28
公開日2024-05-08
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献Enhanced identification of small molecules binding to hnRNP A1 via in silico hotspot and cryptic pockets mapping coupled with X-Ray fragment screening
To Be Published
9F5C
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BU of 9f5c by Molmil
UP1 in complex with Z198195770
分子名称: Heterogeneous nuclear ribonucleoprotein A1, N-terminally processed, N-[3-(carbamoylamino)phenyl]acetamide
著者Dunnett, L, Prischi, F.
登録日2024-04-28
公開日2024-05-08
実験手法X-RAY DIFFRACTION (1.45 Å)
主引用文献Enhanced identification of small molecules binding to hnRNP A1 via in silico hotspot and cryptic pockets mapping coupled with X-Ray fragment screening
To Be Published
9F4E
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BU of 9f4e by Molmil
UP1 in complex with Z1152242726
分子名称: Heterogeneous nuclear ribonucleoprotein A1, N-terminally processed, N-(6-methoxypyridin-3-yl)-N'-thiophen-2-ylurea
著者Dunnett, L, Prischi, F.
登録日2024-04-27
公開日2024-05-08
実験手法X-RAY DIFFRACTION (1.57 Å)
主引用文献Enhanced identification of small molecules binding to hnRNP A1 via in silico hotspot and cryptic pockets mapping coupled with X-Ray fragment screening
To Be Published
9F4N
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BU of 9f4n by Molmil
UP1 in complex with Z137811222
分子名称: 1-[4-(3-phenylpropyl)piperazin-1-yl]ethan-1-one, Heterogeneous nuclear ribonucleoprotein A1, N-terminally processed
著者Dunnett, L, Prischi, F.
登録日2024-04-28
公開日2024-05-08
実験手法X-RAY DIFFRACTION (1.4 Å)
主引用文献Enhanced identification of small molecules binding to hnRNP A1 via in silico hotspot and cryptic pockets mapping coupled with X-Ray fragment screening
To Be Published
9F52
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BU of 9f52 by Molmil
UP1 in complex with Z734147462
分子名称: Heterogeneous nuclear ribonucleoprotein A1, N-terminally processed, [4-(methylamino)oxan-4-yl]methanol
著者Dunnett, L, Prischi, F.
登録日2024-04-28
公開日2024-05-08
実験手法X-RAY DIFFRACTION (1.5 Å)
主引用文献Enhanced identification of small molecules binding to hnRNP A1 via in silico hotspot and cryptic pockets mapping coupled with X-Ray fragment screening
To Be Published
9F4V
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BU of 9f4v by Molmil
UP1 in complex with EN300-118084
分子名称: 3-(difluoromethyl)-1-methyl-1H-pyrazole-4-carboxamide, Heterogeneous nuclear ribonucleoprotein A1, N-terminally processed
著者Dunnett, L, Prischi, F.
登録日2024-04-28
公開日2024-05-08
実験手法X-RAY DIFFRACTION (1.4 Å)
主引用文献Enhanced identification of small molecules binding to hnRNP A1 via in silico hotspot and cryptic pockets mapping coupled with X-Ray fragment screening
To Be Published
9F53
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BU of 9f53 by Molmil
UP1 in complex with Z237527902
分子名称: Heterogeneous nuclear ribonucleoprotein A1, N-terminally processed, N-(5-methyl-1H-pyrazol-3-yl)acetamide
著者Dunnett, L, Prischi, F.
登録日2024-04-28
公開日2024-05-08
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Enhanced identification of small molecules binding to hnRNP A1 via in silico hotspot and cryptic pockets mapping coupled with X-Ray fragment screening
To Be Published
9F7H
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BU of 9f7h by Molmil
UP1 in complex with Z45617795
分子名称: Heterogeneous nuclear ribonucleoprotein A1, N-terminally processed, N-(2-phenylethyl)methanesulfonamide
著者Dunnett, L, Prischi, F.
登録日2024-05-03
公開日2024-05-15
実験手法X-RAY DIFFRACTION (1.43 Å)
主引用文献Enhanced identification of small molecules binding to hnRNP A1 via in silico hotspot and cryptic pockets mapping coupled with X-Ray fragment screening
To Be Published
9F1S
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BU of 9f1s by Molmil
Structure of UP1 S4ES6E phosphomimetic mutant
分子名称: Heterogeneous nuclear ribonucleoprotein A1, N-terminally processed
著者Dunnett, L, Prischi, F.
登録日2024-04-20
公開日2024-05-01
実験手法X-RAY DIFFRACTION (1.5 Å)
主引用文献Structure of UP1 S4ES6E phosphomimetic mutant
To Be Published
9F4R
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BU of 9f4r by Molmil
UP1 in complex with Z802821712
分子名称: Heterogeneous nuclear ribonucleoprotein A1, N-terminally processed, N-ethyl-6-methylpyridazin-3-amine
著者Dunnett, L, Prischi, F.
登録日2024-04-28
公開日2024-05-15
実験手法X-RAY DIFFRACTION (1.59 Å)
主引用文献Enhanced identification of small molecules binding to hnRNP A1 via in silico hotspot and cryptic pockets mapping coupled with X-Ray fragment screening
To Be Published
9F4M
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BU of 9f4m by Molmil
UP1 in complex with Z1401276297
分子名称: (5~{R})-7-pyrazin-2-yl-2-oxa-7-azaspiro[4.4]nonane, Heterogeneous nuclear ribonucleoprotein A1, N-terminally processed
著者Dunnett, L, Prischi, F.
登録日2024-04-28
公開日2024-05-15
実験手法X-RAY DIFFRACTION (1.39 Å)
主引用文献Enhanced identification of small molecules binding to hnRNP A1 via in silico hotspot and cryptic pockets mapping coupled with X-Ray fragment screening
To Be Published
9F4D
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BU of 9f4d by Molmil
UP1 in complex with Z1203107138
分子名称: 1-ethyl-N-[(4-fluorophenyl)methyl]-1H-pyrazole-4-carboxamide, Heterogeneous nuclear ribonucleoprotein A1, N-terminally processed
著者Dunnett, L, Prischi, F.
登録日2024-04-27
公開日2024-05-08
実験手法X-RAY DIFFRACTION (1.5 Å)
主引用文献Enhanced identification of small molecules binding to hnRNP A1 via in silico hotspot and cryptic pockets mapping coupled with X-Ray fragment screening
To Be Published
9F4L
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BU of 9f4l by Molmil
UP1 in complex with Z104584152
分子名称: Heterogeneous nuclear ribonucleoprotein A1, N-terminally processed, N,N-dimethyl-N~2~-phenylglycinamide
著者Dunnett, L, Prischi, F.
登録日2024-04-28
公開日2024-05-08
実験手法X-RAY DIFFRACTION (1.4 Å)
主引用文献Enhanced identification of small molecules binding to hnRNP A1 via in silico hotspot and cryptic pockets mapping coupled with X-Ray fragment screening
To Be Published
9F4P
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BU of 9f4p by Molmil
UP1 in complex with Z1217960891
分子名称: (3S)-3-(3-fluorophenoxy)-1-methylpyrrolidin-2-one, Heterogeneous nuclear ribonucleoprotein A1, N-terminally processed
著者Dunnett, L, Prischi, F.
登録日2024-04-28
公開日2024-05-08
実験手法X-RAY DIFFRACTION (1.4 Å)
主引用文献Enhanced identification of small molecules binding to hnRNP A1 via in silico hotspot and cryptic pockets mapping coupled with X-Ray fragment screening
To Be Published
9F4W
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BU of 9f4w by Molmil
UP1 in complex with Z54508609
分子名称: 1-{[4-(propan-2-yl)phenyl]methyl}piperidin-4-ol, Heterogeneous nuclear ribonucleoprotein A1, N-terminally processed
著者Dunnett, L, Prischi, F.
登録日2024-04-28
公開日2024-05-08
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献Enhanced identification of small molecules binding to hnRNP A1 via in silico hotspot and cryptic pockets mapping coupled with X-Ray fragment screening
To Be Published
9F4Z
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BU of 9f4z by Molmil
UP1 in complex with Z57040482
分子名称: Heterogeneous nuclear ribonucleoprotein A1, N-terminally processed, N-(2-hydroxyphenyl)acetamide
著者Dunnett, L, Prischi, F.
登録日2024-04-28
公開日2024-05-08
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献Enhanced identification of small molecules binding to hnRNP A1 via in silico hotspot and cryptic pockets mapping coupled with X-Ray fragment screening
To Be Published

 

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件を2024-07-03に公開中

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