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6S66
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Crystal structure of hTEAD2 in complex with a trisubstituted pyrazole inhibitor
分子名称: 1-(2-azanylethyl)-3-(3,4-dichlorophenyl)-~{N}-(phenylmethyl)pyrazole-4-carboxamide, MYRISTIC ACID, Transcriptional enhancer factor TEF-4
著者Sturbaut, M, Allemand, F, Guichou, J.F.
登録日2019-07-02
公開日2020-07-22
最終更新日2022-02-02
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Discovery of a cryptic site at the interface 2 of TEAD - Towards a new family of YAP/TAZ-TEAD inhibitors.
Eur.J.Med.Chem., 226, 2021
4UPK
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BU of 4upk by Molmil
Phosphonate monoester hydrolase SpPMH from Silicibacter pomeroyi
分子名称: PHOSPHONATE MONOESTER HYDROLASE
著者Valkov, E, van Loo, B, Hollfelder, F, Hyvonen, M.
登録日2014-06-17
公開日2015-07-01
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (2.24 Å)
主引用文献Balancing Specificity and Promiscuity in Enzyme Evolution: Multidimensional Activity Transitions in the Alkaline Phosphatase Superfamily.
J.Am.Chem.Soc., 141, 2019
6S69
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BU of 6s69 by Molmil
Crystal structure of hTEAD2 in complex with a trisubstituted pyrazole inhibitor
分子名称: 3-[3-(3,4-dichlorophenyl)-4-(2-phenylethylcarbamoyl)pyrazol-1-yl]propanoic acid, MYRISTIC ACID, Transcriptional enhancer factor TEF-4
著者Sturbaut, M, Allemand, F, Guichou, J.F.
登録日2019-07-02
公開日2020-07-22
最終更新日2022-02-02
実験手法X-RAY DIFFRACTION (2.15 Å)
主引用文献Discovery of a cryptic site at the interface 2 of TEAD - Towards a new family of YAP/TAZ-TEAD inhibitors.
Eur.J.Med.Chem., 226, 2021
6S60
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BU of 6s60 by Molmil
Crystal structure of hTEAD2 in complex with a trisubstituted pyrazole inhibitor
分子名称: 4-[3-(3,4-dichlorophenyl)-4-[(phenylmethyl)carbamoyl]pyrazol-1-yl]butanoic acid, MYRISTIC ACID, Transcriptional enhancer factor TEF-4
著者Sturbaut, M, Allemand, F, Guichou, J.F.
登録日2019-07-02
公開日2020-07-22
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Discovery of a cryptic site at the interface 2 of TEAD - Towards a new family of YAP/TAZ-TEAD inhibitors.
Eur.J.Med.Chem., 226, 2021
6S64
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BU of 6s64 by Molmil
Crystal structure of hTEAD2 in complex with a trisubstituted pyrazole inhibitor
分子名称: 3-[3-(3,4-dichlorophenyl)-4-[(phenylmethyl)carbamoyl]pyrazol-1-yl]propanoic acid, MYRISTIC ACID, PALMITIC ACID, ...
著者Sturbaut, M, Allemand, F, Guichou, J.F.
登録日2019-07-02
公開日2020-07-22
最終更新日2022-02-02
実験手法X-RAY DIFFRACTION (2.22 Å)
主引用文献Discovery of a cryptic site at the interface 2 of TEAD - Towards a new family of YAP/TAZ-TEAD inhibitors.
Eur.J.Med.Chem., 226, 2021
6S6J
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BU of 6s6j by Molmil
Crystal structure of hTEAD2 in complex with a trisubstituted pyrazole inhibitor
分子名称: MYRISTIC ACID, Transcriptional enhancer factor TEF-4, ethyl 1-(4-azanylbutyl)-3-(3,4-dichlorophenyl)pyrazole-4-carboxylate
著者Sturbaut, M, Allemand, F, Guichou, J.F.
登録日2019-07-03
公開日2020-07-22
最終更新日2022-02-02
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Discovery of a cryptic site at the interface 2 of TEAD - Towards a new family of YAP/TAZ-TEAD inhibitors.
Eur.J.Med.Chem., 226, 2021
1ZH2
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BU of 1zh2 by Molmil
Crystal Structure Of The Calcium-Bound Receiver Domain Of Kdp Potassium Transport System Response Regulator KdpE
分子名称: CALCIUM ION, KDP operon transcriptional regulatory protein kdpE
著者Toro-Roman, A, Wu, T, Stock, A.M.
登録日2005-04-22
公開日2005-12-13
最終更新日2023-08-23
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献A common dimerization interface in bacterial response regulators KdpE and TorR.
Protein Sci., 14, 2005
1ZH4
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Crystal Structure Of The Mg+2/BeF3-Bound Receiver Domain Of Kdp Potassium Transport System Response Regulator KdpE
分子名称: BERYLLIUM TRIFLUORIDE ION, KDP operon transcriptional regulatory protein kdpE, MAGNESIUM ION
著者Toro-Roman, A, Wu, T, Stock, A.M.
登録日2005-04-22
公開日2005-12-13
最終更新日2023-08-23
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献A common dimerization interface in bacterial response regulators KdpE and TorR.
Protein Sci., 14, 2005
1ZGZ
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BU of 1zgz by Molmil
Crystal Structure Of The Receiver Domain Of TMAO Respiratory System Response Regulator TorR
分子名称: GLYCEROL, SULFATE ION, TorCAD operon transcriptional regulatory protein torR
著者Toro-Roman, A, Wu, T, Stock, A.M.
登録日2005-04-22
公開日2005-12-13
最終更新日2021-10-20
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献A common dimerization interface in bacterial response regulators KdpE and TorR.
Protein Sci., 14, 2005
7CMQ
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BU of 7cmq by Molmil
Crystal Structure of Bacillus sp. TB-90 Urate Oxidase Improved by Humidity Control at 88% RH.
分子名称: 1,2-ETHANEDIOL, 8-AZAXANTHINE, OXYGEN MOLECULE, ...
著者Hibi, T, Itoh, T, Nishiya, Y.
登録日2020-07-28
公開日2020-08-12
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (1.65 Å)
主引用文献Flexibility of a Distal Interface Loop Modulates Water Network in the Active Site of Bacillus sp. TB-90 Urate Oxidase
To be published
7CMN
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Crystal Structure of Bacillus sp. TB-90 Urate Oxidase Improved by Humidity Control at 88% RH.
分子名称: 1,2-ETHANEDIOL, 8-AZAXANTHINE, OXYGEN MOLECULE, ...
著者Hibi, T, Itoh, T, Nishiya, Y.
登録日2020-07-28
公開日2020-08-12
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (1.42 Å)
主引用文献Flexibility of a Distal Interface Loop Modulates Water Network in the Active Site of Bacillus sp. TB-90 Urate Oxidase
To be published
7UGR
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BU of 7ugr by Molmil
Crystal structure of hyperfolder YFP
分子名称: 1,2-ETHANEDIOL, DI(HYDROXYETHYL)ETHER, Hyperfolder yellow fluorescent protein, ...
著者Campbell, B.C, Liu, C.F, Petsko, G.A.
登録日2022-03-25
公開日2022-10-26
最終更新日2023-11-15
実験手法X-RAY DIFFRACTION (1.74 Å)
主引用文献Chemically stable fluorescent proteins for advanced microscopy.
Nat.Methods, 19, 2022
7D8T
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BU of 7d8t by Molmil
MITF bHLHLZ complex with M-box DNA
分子名称: DNA (5'-D(*TP*GP*TP*AP*AP*CP*AP*TP*GP*TP*GP*TP*CP*CP*CP*C)-3'), DNA (5'-D(P*GP*GP*GP*AP*CP*AP*CP*AP*TP*GP*TP*TP*AP*CP*AP*G)-3'), Microphthalmia-associated transcription factor,Methionyl-tRNA synthetase beta subunit
著者Guo, M, Fang, P, Wang, J.
登録日2020-10-09
公開日2021-10-13
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (3.201 Å)
主引用文献A unique hyperdynamic dimer interface permits small molecule perturbation of the melanoma oncoprotein MITF for melanoma therapy.
Cell Res., 33, 2023
7D8R
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BU of 7d8r by Molmil
MITF HLHLZ structure
分子名称: Microphthalmia-associated transcription factor,Methionyl-tRNA synthetase beta subunit
著者Guo, M, Fang, P, Wang, J.
登録日2020-10-09
公開日2021-10-13
最終更新日2023-09-27
実験手法X-RAY DIFFRACTION (3 Å)
主引用文献A unique hyperdynamic dimer interface permits small molecule perturbation of the melanoma oncoprotein MITF for melanoma therapy.
Cell Res., 33, 2023
7D8S
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BU of 7d8s by Molmil
MITF bHLHLZ apo structure
分子名称: Microphthalmia-associated transcription factor,Methionyl-tRNA synthetase beta subunit, SULFATE ION
著者Guo, M, Fang, P, Wang, J.
登録日2020-10-09
公開日2021-10-13
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (2.28 Å)
主引用文献A unique hyperdynamic dimer interface permits small molecule perturbation of the melanoma oncoprotein MITF for melanoma therapy.
Cell Res., 33, 2023
7DCK
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BU of 7dck by Molmil
Crystal structure of phosphodiesterase tw9814
分子名称: Lactamase_B domain-containing protein, MANGANESE (II) ION
著者Heo, Y, Yun, J.H, Park, J.H, Park, S.B, Cha, S.S, Lee, W.
登録日2020-10-26
公開日2021-10-27
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (2.34 Å)
主引用文献Structural and functional identification of the uncharacterized metallo-beta-lactamase superfamily protein TW9814 as a phosphodiesterase with unique metal coordination.
Acta Crystallogr D Struct Biol, 78, 2022
4UPH
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BU of 4uph by Molmil
Crystal Structure of Phosphonate Monoester Hydrolase of Agrobacterium radiobacter
分子名称: CHLORIDE ION, MAGNESIUM ION, SULFATASE (SULFURIC ESTER HYDROLASE) PROTEIN
著者Fischer, G, Loo, B.v, Hyvonen, M, Hollfelder, F.
登録日2014-06-17
公開日2015-07-01
最終更新日2019-07-10
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Balancing Specificity and Promiscuity in Enzyme Evolution: Multidimensional Activity Transitions in the Alkaline Phosphatase Superfamily.
J.Am.Chem.Soc., 141, 2019
6OTD
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BU of 6otd by Molmil
Globin sensor domain of AfGcHK in monomeric form, with imidazole
分子名称: (4S)-2-METHYL-2,4-PENTANEDIOL, Globin-coupled histidine kinase, IMIDAZOLE, ...
著者Skalova, T, Dohnalek, J, Kolenko, P, Stranava, M, Lengalova, A, Martinkova, M.
登録日2019-05-03
公開日2020-01-08
最終更新日2023-10-11
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Disruption of the dimerization interface of the sensing domain in the dimeric heme-based oxygen sensorAfGcHK abolishes bacterial signal transduction.
J.Biol.Chem., 295, 2020
4Z07
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BU of 4z07 by Molmil
Co-crystal structure of the tandem CNB (CNB-A/B) domains of human PKG I beta with cGMP
分子名称: CYCLIC GUANOSINE MONOPHOSPHATE, ISOPROPYL ALCOHOL, SULFATE ION, ...
著者Kim, J.J, Reger, A.S, Arold, S.T, Kim, C.
登録日2015-03-25
公開日2016-04-13
最終更新日2023-09-27
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Crystal Structure of PKG I:cGMP Complex Reveals a cGMP-Mediated Dimeric Interface that Facilitates cGMP-Induced Activation.
Structure, 24, 2016
6HTF
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BU of 6htf by Molmil
Crystal structure of human Btk SH2 domain bound to rF10 repebody
分子名称: Tyrosine-protein kinase BTK, rF10 repebody
著者Duarte, D.P, Pojer, F, Hantschel, O.
登録日2018-10-04
公開日2020-05-20
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (2.102 Å)
主引用文献Btk SH2-kinase interface is critical for allosteric kinase activation and its targeting inhibits B-cell neoplasms.
Nat Commun, 11, 2020
8U89
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BU of 8u89 by Molmil
The structure of the PP2A-B56Delta holoenzyme mutant - E197K
分子名称: MANGANESE (II) ION, Serine/threonine-protein phosphatase 2A 56 kDa regulatory subunit delta isoform, Serine/threonine-protein phosphatase 2A 65 kDa regulatory subunit A alpha isoform, ...
著者Wu, C.G, Xing, Y.
登録日2023-09-16
公開日2024-01-10
実験手法ELECTRON MICROSCOPY (3.3 Å)
主引用文献B56 delta long-disordered arms form a dynamic PP2A regulation interface coupled with global allostery and Jordan's syndrome mutations.
Proc.Natl.Acad.Sci.USA, 121, 2024
8U1X
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BU of 8u1x by Molmil
The structure of the PP2A-B56Delta holoenzyme mutant - E197K
分子名称: MANGANESE (II) ION, Serine/threonine-protein phosphatase 2A 56 kDa regulatory subunit delta isoform, Serine/threonine-protein phosphatase 2A 65 kDa regulatory subunit A alpha isoform, ...
著者Wu, C.G, Xing, Y.
登録日2023-09-04
公開日2024-01-17
実験手法ELECTRON MICROSCOPY (2.7 Å)
主引用文献B56 delta long-disordered arms form a dynamic PP2A regulation interface coupled with global allostery and Jordan's syndrome mutations.
Proc.Natl.Acad.Sci.USA, 121, 2024
8BTJ
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BU of 8btj by Molmil
Murine cytomegalovirus protein M35
分子名称: (R,R)-2,3-BUTANEDIOL, MALONATE ION, Protein M35
著者Schmelz, S, Van den Heuvel, J, Blankenfeldt, W.
登録日2022-11-29
公開日2023-10-11
実験手法X-RAY DIFFRACTION (1.94 Å)
主引用文献The Cytomegalovirus M35 Protein Directly Binds to the Interferon-beta Enhancer and Modulates Transcription of Ifnb1 and Other IRF3-Driven Genes.
J.Virol., 97, 2023
7JM4
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IRF Transcription Factor
分子名称: Interferon regulatory factor 4, Interferon-Stimulated Response Elements
著者Sundararaj, S, Williams, S.J, Casarotto, M.G.
登録日2020-07-31
公開日2021-03-24
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (2.95 Å)
主引用文献Structural determinants of the IRF4/DNA homodimeric complex.
Nucleic Acids Res., 49, 2021
7PLN
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Structure of the APCbeta domain of Plasmodium vivax perforin-like protein 1
分子名称: Sporozoite micronemal protein essential for cell traversal, putative
著者Williams, S.I, Ni, T, Yu, X, Gilbert, R.J.C.
登録日2021-08-31
公開日2022-06-29
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (3.15 Å)
主引用文献Structural, Functional and Computational Studies of Membrane Recognition by Plasmodium Perforin-Like Proteins 1 and 2
J.Mol.Biol., 434, 2022

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件を2024-08-07に公開中

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