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8FSY
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BU of 8fsy by Molmil
Crystal structure of hen egg white lysozyme
分子名称: Lysozyme C, SODIUM ION
著者Lima, L.M.T.R, Ramos, N.G.
登録日2023-01-11
公開日2024-01-17
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献Crystal structure of hen egg white lysozyme
To Be Published
8FSX
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BU of 8fsx by Molmil
Crystal structure of hen egg white lysozyme
分子名称: Lysozyme C, SODIUM ION
著者Lima, L.M.T.R, Ramos, N.G.
登録日2023-01-11
公開日2024-01-17
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献Crystal structure of hen egg white lysozyme
To Be Published
4N7P
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BU of 4n7p by Molmil
Capturing the haemoglobin allosteric transition in a single crystal form; Crystal structure of half-liganded human haemoglobin without phosphate at 2.8 A resolution.
分子名称: Hemoglobin subunit alpha, Hemoglobin subunit beta, PROTOPORPHYRIN IX CONTAINING FE, ...
著者Sugiyama, K, Shibayama, N, Park, S.Y.
登録日2013-10-16
公開日2014-04-02
最終更新日2024-03-20
実験手法X-RAY DIFFRACTION (2.809 Å)
主引用文献Capturing the hemoglobin allosteric transition in a single crystal form
J.Am.Chem.Soc., 136, 2014
6DZH
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BU of 6dzh by Molmil
HRAS G13D bound to GDP (H13GDP)
分子名称: 2,3-DIHYDROXY-1,4-DITHIOBUTANE, CALCIUM ION, GLYCEROL, ...
著者Johnson, C.W, Mattos, C.
登録日2018-07-04
公開日2019-07-10
最終更新日2023-10-11
実験手法X-RAY DIFFRACTION (1.95 Å)
主引用文献Isoform-Specific Destabilization of the Active Site Reveals a Molecular Mechanism of Intrinsic Activation of KRas G13D.
Cell Rep, 28, 2019
7LZK
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BU of 7lzk by Molmil
DHP B in complex with 2,4-Dichlorophenol substrate
分子名称: 2,4-dichlorophenol, Dehaloperoxidase B, GLYCEROL, ...
著者Carey, L.M, Ghiladi, R.A.
登録日2021-03-10
公開日2022-03-16
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (1.49 Å)
主引用文献Mechanistic and Structural Studies of 2,4-dihalophenol: Bridging the Functional Gap between Reactivity and Inhibition in Dehaloperoxidase
To Be Published
8FT3
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BU of 8ft3 by Molmil
Crystal structure of hen egg white lysozyme
分子名称: Lysozyme C, SODIUM ION
著者Lima, L.M.T.R, Ramos, N.G.
登録日2023-01-11
公開日2024-01-17
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献Crystal structure of hen egg white lysozyme
To Be Published
8FT1
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BU of 8ft1 by Molmil
Crystal structure of hen egg white lysozyme
分子名称: Lysozyme C, SODIUM ION
著者Lima, L.M.T.R, Ramos, N.G.
登録日2023-01-11
公開日2024-01-17
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献Crystal structure of hen egg white lysozyme
To Be Published
6DZF
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BU of 6dzf by Molmil
Orthorhombic trypsin cryocooled to 100 K with 20% xylose as cryoprotectant
分子名称: BENZAMIDINE, CALCIUM ION, Cationic trypsin, ...
著者Juers, D.H.
登録日2018-07-03
公開日2018-09-19
最終更新日2023-10-11
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献The impact of cryosolution thermal contraction on proteins and protein crystals: volumes, conformation and order.
Acta Crystallogr D Struct Biol, 74, 2018
6KUB
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BU of 6kub by Molmil
Crystal structure of Plasmodium falciparum histo-aspartic protease (HAP) zymogen (Form 1)
分子名称: DI(HYDROXYETHYL)ETHER, GLYCEROL, HAP protein
著者Rathore, I, Mishra, V, Bhaumik, P.
登録日2019-08-31
公開日2020-05-27
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Activation mechanism of plasmepsins, pepsin-like aspartic proteases from Plasmodium, follows a unique trans-activation pathway.
Febs J., 288, 2021
6E02
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BU of 6e02 by Molmil
WT swMb-MeNO
分子名称: Myoglobin, NITROSOMETHANE, PROTOPORPHYRIN IX CONTAINING FE, ...
著者Herrera, V.E.
登録日2018-07-05
公開日2019-07-17
最終更新日2023-11-08
実験手法X-RAY DIFFRACTION (1.76 Å)
主引用文献Insights into Nitrosoalkane Binding to Myoglobin Provided by Crystallography of Wild-Type and Distal Pocket Mutant Derivatives.
Biochemistry, 62, 2023
4N8T
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BU of 4n8t by Molmil
Human hemoglobin nitric oxide adduct
分子名称: Hemoglobin subunit alpha, Hemoglobin subunit beta, NITRIC OXIDE, ...
著者Yi, J, Richter-Addo, G.B.
登録日2013-10-18
公開日2014-10-08
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Crystallographic characterization of the nitric oxide derivative of R-state human hemoglobin.
Nitric Oxide, 39, 2014
7LZ5
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BU of 7lz5 by Molmil
Crystal structure of oncogenic KRAS Q61E GMPPCP-bound
分子名称: Isoform 2B of GTPase KRas, MAGNESIUM ION, PHOSPHOMETHYLPHOSPHONIC ACID GUANYLATE ESTER
著者Carey, L.M, Campbell, S.L.
登録日2021-03-09
公開日2022-03-16
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (1.5 Å)
主引用文献Crystal structure of oncogenic KRAS Q61E GMPPCP-bound
To Be Published
7CK4
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BU of 7ck4 by Molmil
Structural and functional analysis of small heat shock protein from Synechococcus phage S-ShM2
分子名称: Heat shock protein
著者Biswas, S, Suguna, K.
登録日2020-07-15
公開日2021-07-21
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (7 Å)
主引用文献Multiple nanocages of a cyanophage small heat shock protein with icosahedral and octahedral symmetries.
Sci Rep, 11, 2021
8FZ8
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BU of 8fz8 by Molmil
Structure of cytochrome P450sky2
分子名称: Cytochrome P450, OCTANOIC ACID (CAPRYLIC ACID), PROTOPORPHYRIN IX CONTAINING FE
著者Murarka, V.C, Poulos, T.L.
登録日2023-01-27
公開日2024-02-07
最終更新日2024-04-10
実験手法X-RAY DIFFRACTION (1.43 Å)
主引用文献Biosynthesis of a new skyllamycin in Streptomyces nodosus : a cytochrome P450 forms an epoxide in the cinnamoyl chain.
Org.Biomol.Chem., 22, 2024
7CL7
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BU of 7cl7 by Molmil
Substrate-free structure of CYP154C2 from Streptomyces avermitilis in an open conformation
分子名称: Cytochrome P450 hydroxylase, DI(HYDROXYETHYL)ETHER, PROTOPORPHYRIN IX CONTAINING FE
著者Xu, L.H, Fushinobu, S.
登録日2020-07-20
公開日2021-07-21
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (1.95 Å)
主引用文献Substrate-free structure of CYP154C2 in an open conformation
To Be Published
7CL9
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BU of 7cl9 by Molmil
Androstenedione-bound structure of CYP154C2 from Streptomyces avermitilis in an open conformation
分子名称: 4-ANDROSTENE-3-17-DIONE, Cytochrome P450 hydroxylase, DI(HYDROXYETHYL)ETHER, ...
著者Xu, L.H, Fushinobu, S.
登録日2020-07-20
公開日2021-07-21
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (1.95 Å)
主引用文献Androstenedione-bound structure of CYP154C2 from Streptomyces avermitilis in an open conformation
To Be Published
6KQU
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BU of 6kqu by Molmil
Crystal structure of phospholipase A2
分子名称: 2-[3-(2-HYDROXY-1,1-DIHYDROXYMETHYL-ETHYLAMINO)-PROPYLAMINO]-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, CALCIUM ION, CHLORIDE ION, ...
著者Hou, S, Xu, T, Liu, J.
登録日2019-08-18
公開日2020-08-19
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Residue Asn21 acts as a switch for calcium binding to modulate the enzymatic activity of human phospholipase A2 group IIE.
Biochimie, 176, 2020
4N9R
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BU of 4n9r by Molmil
X-ray structure of the complex between hen egg white lysozyme and pentacholrocarbonyliridate(III) (1 day)
分子名称: CHLORIDE ION, Lysozyme C, SODIUM ION, ...
著者Petruk, A.A, Bikiel, D.E, Vergara, A, Merlino, A.
登録日2013-10-21
公開日2015-12-30
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (1.55 Å)
主引用文献Interaction between proteins and Ir based CO releasing molecules: mechanism of adduct formation and CO release.
Inorg.Chem., 53, 2014
7LZN
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BU of 7lzn by Molmil
DHP B in complex with 2,4-Dichlorophenol substrate
分子名称: 2,4-dichlorophenol, Dehaloperoxidase B, GLYCEROL, ...
著者Carey, L.M, Ghiladi, R.A.
登録日2021-03-10
公開日2022-03-16
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (1.95 Å)
主引用文献Mechanistic and Structural Studies of 2,4-dihalophenol: Bridging the Functional Gap between Reactivity and Inhibition in Dehaloperoxidase
To Be Published
4MWL
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BU of 4mwl by Molmil
Shanghai N9
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, CALCIUM ION, Neuraminidase, ...
著者Wu, Y, Qi, J.X, Gao, F, Gao, G.F.
登録日2013-09-25
公開日2013-11-20
最終更新日2020-07-29
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Characterization of two distinct neuraminidases from avian-origin human-infecting H7N9 influenza viruses
Cell Res., 23, 2013
7CL8
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BU of 7cl8 by Molmil
Testosterone-bound structure of CYP154C2 from Streptomyces avermitilis in an closed conformation
分子名称: Cytochrome P450 hydroxylase, DI(HYDROXYETHYL)ETHER, PROTOPORPHYRIN IX CONTAINING FE, ...
著者Xu, L.H, Fushinobu, S.
登録日2020-07-20
公開日2021-07-21
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (1.42 Å)
主引用文献Improved 2 alpha-Hydroxylation Efficiency of Steroids by CYP154C2 Using Structure-Guided Rational Design.
Appl.Environ.Microbiol., 89, 2023
5VLO
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BU of 5vlo by Molmil
The structure of human CamKII with bound inhibitor
分子名称: 2,3-DIHYDROXY-1,4-DITHIOBUTANE, Calcium/calmodulin-dependent protein kinase type II subunit delta, N-[(2S)-2-(diethylamino)propyl]-2-[(2S)-2-(methylcarbamoyl)azetidin-1-yl]-6-[5-(thiophen-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]pyridine-4-carboxamide
著者Somoza, J.R, Villasenor, A.G.
登録日2017-04-25
公開日2017-08-23
最終更新日2024-03-13
実験手法X-RAY DIFFRACTION (2.05 Å)
主引用文献Inhibitors of CamKII
To Be Published
7CMB
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BU of 7cmb by Molmil
Crystal Structure of PAK4 in complex with inhibitor 41
分子名称: 1-(2-azanylpyrimidin-4-yl)-6-[2-(1-oxidanylcyclohexyl)ethynyl]indole-3-carboxamide, Serine/threonine-protein kinase PAK 4
著者Zhao, F, Li, H.
登録日2020-07-26
公開日2021-07-28
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (2.592 Å)
主引用文献Discovery of 6-ethynyl-1H-indole-3-carboxamide Derivatives as Highly Potent and Selective p21-Activated Kinase 4 (PAK4) Inhibitors
to be published
5ZA7
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BU of 5za7 by Molmil
uPA-HMA
分子名称: 3-azanyl-5-(azepan-1-yl)-N-[bis(azanyl)methylidene]-6-chloranyl-pyrazine-2-carboxamide, SULFATE ION, Urokinase-type plasminogen activator chain B
著者Buckley, B.J, Jiang, L.G, Huang, M.D, Kelso, M.J, Ranson, M.
登録日2018-02-06
公開日2018-12-19
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (1.7 Å)
主引用文献6-Substituted Hexamethylene Amiloride (HMA) Derivatives as Potent and Selective Inhibitors of the Human Urokinase Plasminogen Activator for Use in Cancer.
J. Med. Chem., 61, 2018
4NM3
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BU of 4nm3 by Molmil
Crystal structure of GSK-3/Axin complex bound to phosphorylated N-terminal auto-inhibitory pS9 peptide
分子名称: 2,3-DIHYDROXY-1,4-DITHIOBUTANE, ADENOSINE-5'-DIPHOSPHATE, Axin-1, ...
著者Chu, M.L.-H, Stamos, J.L, Enos, M.D, Shah, N, Weis, W.I.
登録日2013-11-14
公開日2014-03-26
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Structural basis of GSK-3 inhibition by N-terminal phosphorylation and by the Wnt receptor LRP6.
Elife, 3, 2014

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件を2024-08-07に公開中

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