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8RFS
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Low pH (5.5) nitrite-bound MSOX movie series dataset 11 of the copper nitrite reductase (NirK) from Bradyrhizobium japonicum USDA110 [6.71 MGy] - water ligand
分子名称: COPPER (II) ION, Copper-containing nitrite reductase, NITRITE ION, ...
著者Rose, S.L, Ferroni, F.M, Antonyuk, S.V, Eady, R.R, Hasnain, S.S.
登録日2023-12-13
公開日2024-07-24
最終更新日2024-08-07
実験手法X-RAY DIFFRACTION (1.54 Å)
主引用文献Spectroscopically Validated pH-dependent MSOX Movies Provide Detailed Mechanism of Copper Nitrite Reductases.
J.Mol.Biol., 436, 2024
8BHE
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K141H and S142H double mutant of hGSTA1-1
分子名称: Glutathione S-transferase A1
著者Papageorgiou, A.C, Poudel, N.
登録日2022-10-31
公開日2023-03-08
最終更新日2024-06-19
実験手法X-RAY DIFFRACTION (1.87 Å)
主引用文献A Key Role in Catalysis and Enzyme Thermostability of a Conserved Helix H5 Motif of Human Glutathione Transferase A1-1.
Int J Mol Sci, 24, 2023
8RG9
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BU of 8rg9 by Molmil
High pH (8.0) nitrite-bound MSOX movie series dataset 2 of the copper nitrite reductase from Bradyrhizobium sp. ORS375 (two-domain) [1.36 MGy]
分子名称: COPPER (II) ION, Copper-containing nitrite reductase, GLYCEROL, ...
著者Rose, S.L, Ferroni, F.M, Antonyuk, S.V, Eady, R.R, Hasnain, S.S.
登録日2023-12-13
公開日2024-07-24
最終更新日2024-08-07
実験手法X-RAY DIFFRACTION (1.25 Å)
主引用文献Spectroscopically Validated pH-dependent MSOX Movies Provide Detailed Mechanism of Copper Nitrite Reductases.
J.Mol.Biol., 436, 2024
8BLS
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BU of 8bls by Molmil
Structure of Lactobacillus salivarius (Ls) bile salt hydrolase(BSH) in complex with Glycocholate (GCA)
分子名称: Bile salt hydrolase, GLYCOCHOLIC ACID
著者Karlov, D.S, Long, S.L, Zeng, X, Xu, F, Lal, K, Cao, L, Hayoun, K, Lin, J, Joyce, S.A, Tikhonova, I.G.
登録日2022-11-10
公開日2023-03-08
最終更新日2024-02-14
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Characterization of the mechanism of bile salt hydrolase substrate specificity by experimental and computational analyses.
Structure, 31, 2023
8RTC
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BU of 8rtc by Molmil
Rap from bacteriophage Phi3T in presence of pheromone RGHTS
分子名称: Glycerol ethoxylate, Pheromone RGHTS, Rap3T
著者Felipe-Ruiz, A, Zamora-Caballero, S, Marina, A.
登録日2024-01-25
公開日2024-07-24
最終更新日2024-08-28
実験手法X-RAY DIFFRACTION (2.83 Å)
主引用文献Extracellular proteolysis of tandemly duplicated pheromone propeptides affords additional complexity to bacterial quorum sensing.
Plos Biol., 22, 2024
7MON
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BU of 7mon by Molmil
Structure of human RIPK3-MLKL complex
分子名称: Mixed lineage kinase domain-like protein, N-[4-({2-[(cyclopropanecarbonyl)amino]pyridin-4-yl}oxy)-3-fluorophenyl]-1-(4-fluorophenyl)-2-oxo-1,2-dihydropyridine-3-carboxamide, Receptor-interacting serine/threonine-protein kinase 3
著者Meng, Y, Davies, K.A, Czabotar, P.E, Murphy, J.M.
登録日2021-05-03
公開日2021-11-17
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (2.23 Å)
主引用文献Human RIPK3 maintains MLKL in an inactive conformation prior to cell death by necroptosis.
Nat Commun, 12, 2021
6JUV
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BU of 6juv by Molmil
Crytsal structure of ScpB derived from Pyrococcus yayanosii
分子名称: CHLORIDE ION, Segregation and condensation protein B
著者Jeon, J.-H, Lee, H, Oh, B.-H.
登録日2019-04-15
公開日2020-01-22
最終更新日2024-10-23
実験手法X-RAY DIFFRACTION (3.043 Å)
主引用文献Archaeal Smc-based condensin lacking kite subunits
Iucrj, 2020
8RYV
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BU of 8ryv by Molmil
MSOX movie series dataset 10 (11.5 MGy) for nitrite bound BrJNiR (Cu containing nitrite reductase (NirK) from Bradyrhizobium japonicum USDA110 at pH 8.
分子名称: COPPER (II) ION, Copper-containing nitrite reductase, NITRIC OXIDE, ...
著者Rose, S.L, Ferroni, F.M, Horrell, S, Brondino, C.D, Eady, R.R, Jaho, S, Hough, M.A, Owen, A.L, Antonyuk, S.V, Hasnain, S.S.
登録日2024-02-09
公開日2024-07-24
最終更新日2024-08-07
実験手法X-RAY DIFFRACTION (1.45 Å)
主引用文献Spectroscopically Validated pH-dependent MSOX Movies Provide Detailed Mechanism of Copper Nitrite Reductases.
J.Mol.Biol., 436, 2024
8RZG
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BU of 8rzg by Molmil
ZgGH129 from Zobellia galactanivorans soaked with the product of the reaction ADG (3,6-anhydro-D-galactose).
分子名称: (1~{R},4~{S},5~{R},8~{S})-2,6-dioxabicyclo[3.2.1]octane-4,8-diol, 1,2-ETHANEDIOL, CHLORIDE ION, ...
著者Roret, T, Czjzek, M, Ficko-Blean, E.
登録日2024-02-12
公開日2024-07-31
最終更新日2024-10-23
実験手法X-RAY DIFFRACTION (1.81 Å)
主引用文献Constrained Catalytic Itinerary of a Retaining 3,6-Anhydro-D-Galactosidase, a Key Enzyme in Red Algal Cell Wall Degradation.
Angew.Chem.Int.Ed.Engl., 63, 2024
8BQP
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BU of 8bqp by Molmil
Hen Egg-White Lysozyme (HEWL) complexed with methyl-functionalised Anderson-Evans polyoxometalate
分子名称: ACETATE ION, CHLORIDE ION, Lysozyme C, ...
著者Lentink, S, Salazar Marcano, D.E, Moussawi, M.A, Vandebroek, L, Van Meervelt, L, Parac-Vogt, T.N.
登録日2022-11-21
公開日2023-03-08
最終更新日2024-11-06
実験手法X-RAY DIFFRACTION (1.24 Å)
主引用文献Fine-tuning non-covalent interactions between hybrid metal-oxo clusters and proteins.
Faraday Disc.Chem.Soc, 244, 2023
8RFP
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BU of 8rfp by Molmil
Low pH (5.5) nitrite-bound MSOX movie series dataset 3 of the copper nitrite reductase (NirK) from Bradyrhizobium japonicum USDA110 [1.83 MGy] - nitrite/NO intermediate
分子名称: COPPER (II) ION, Copper-containing nitrite reductase, NITRIC OXIDE, ...
著者Rose, S.L, Ferroni, F.M, Antonyuk, S.V, Eady, R.R, Hasnain, S.S.
登録日2023-12-13
公開日2024-07-24
最終更新日2024-08-07
実験手法X-RAY DIFFRACTION (1.23 Å)
主引用文献Spectroscopically Validated pH-dependent MSOX Movies Provide Detailed Mechanism of Copper Nitrite Reductases.
J.Mol.Biol., 436, 2024
8BHC
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BU of 8bhc by Molmil
K141H and S142H double mutant of hGSTA1-1
分子名称: Glutathione S-transferase A1
著者Papageorgiou, A.C, Poudel, N.
登録日2022-10-31
公開日2023-03-08
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (1.56 Å)
主引用文献A Key Role in Catalysis and Enzyme Thermostability of a Conserved Helix H5 Motif of Human Glutathione Transferase A1-1.
Int J Mol Sci, 24, 2023
8TGT
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BU of 8tgt by Molmil
Structure of human C4b-binding protein alpha chain CCP domains 1 and 2 in complex with the hypervariable region of group A Streptococcus M68 protein
分子名称: 1,2-ETHANEDIOL, C4b-binding protein alpha chain, CALCIUM ION, ...
著者Kolesinski, P, Ghosh, P.
登録日2023-07-13
公開日2024-07-17
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Structure of human C4b-binding protein alpha chain CCP domains 1 and 2 in complex with the hypervariable region of group A Streptococcus M68 protein
To Be Published
8TX5
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BU of 8tx5 by Molmil
Crystal structure of an engineered variant of galactose oxidase, GOaseRd4BB, from Fusarium graminearum
分子名称: COPPER (II) ION, GLYCEROL, Galactose oxidase
著者Selvaraj, B, Orth, P.
登録日2023-08-22
公開日2024-07-03
最終更新日2024-10-16
実験手法X-RAY DIFFRACTION (1.93 Å)
主引用文献Development of a Biocatalytic Aerobic Oxidation for the Manufacturing Route to Islatravir
Chemrxiv, 2023
8BLT
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BU of 8blt by Molmil
Structure of Lactobacillus salivarius (Ls) bile salt hydrolase(BSH) in complex with taurocholate (TCA)
分子名称: Bile salt hydrolase, TAUROCHOLIC ACID
著者Karlov, D.S, Long, S.L, Zeng, X, Xu, F, Lal, K, Cao, L, Hayoun, K, Lin, J, Joyce, S.A, Tikhonova, I.G.
登録日2022-11-10
公開日2023-03-08
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Characterization of the mechanism of bile salt hydrolase substrate specificity by experimental and computational analyses.
Structure, 31, 2023
7MP8
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BU of 7mp8 by Molmil
Crystal structure of the cytosolic domain of Tribolium castaneum PINK1 in the non-phosphorylated state
分子名称: SULFATE ION, Serine/threonine-protein kinase PINK1, mitochondrial-like Protein
著者Rasool, S, Veyron, S, Trempe, J.F.
登録日2021-05-04
公開日2021-12-01
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (3 Å)
主引用文献Mechanism of PINK1 activation by autophosphorylation and insights into assembly on the TOM complex.
Mol.Cell, 82, 2022
7MPY
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BU of 7mpy by Molmil
Crystal structure of cytosolic HPPK-DHPS from A.thaliana
分子名称: Folate synthesis bifunctional protein
著者Vadlamani, G, Bond, C.S.
登録日2021-05-05
公開日2021-12-08
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Crystal structure of Arabidopsis thaliana HPPK/DHPS, a bifunctional enzyme and target of the herbicide asulam.
Plant Commun., 3, 2022
8TD5
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BU of 8td5 by Molmil
Structure of PYCR1 complexed with NADH and Tetrahydrothiophene-2-carboxylic acid
分子名称: (2R)-thiolane-2-carboxylic acid, 1,4-DIHYDRONICOTINAMIDE ADENINE DINUCLEOTIDE, Pyrroline-5-carboxylate reductase 1, ...
著者Tanner, J.J, Meeks, K.R.
登録日2023-07-02
公開日2024-07-03
最終更新日2024-09-18
実験手法X-RAY DIFFRACTION (1.81 Å)
主引用文献Screening a knowledge-based library of low molecular weight compounds against the proline biosynthetic enzyme 1-pyrroline-5-carboxylate 1 (PYCR1).
Protein Sci., 33, 2024
6CDB
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BU of 6cdb by Molmil
Crystal Structure of V66L CzrA in the Zn(II)bound state
分子名称: ArsR family transcriptional regulator, CHLORIDE ION, SODIUM ION, ...
著者Capdevila, D.A, Campanello, G, Gonzalez-Gutierrez, G, Giedroc, D.P.
登録日2018-02-08
公開日2018-07-11
最終更新日2024-03-13
実験手法X-RAY DIFFRACTION (1.99 Å)
主引用文献Functional Role of Solvent Entropy and Conformational Entropy of Metal Binding in a Dynamically Driven Allosteric System.
J. Am. Chem. Soc., 140, 2018
8TE9
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BU of 8te9 by Molmil
Crystal Structure of an Isethionate bound Substrate Binding Protein (IseP) from an Isethionate TRAP Transporter
分子名称: 1,2-ETHANEDIOL, 2-hydroxyethylsulfonic acid, Isethionate-binding periplasmic protein DctP, ...
著者Newton-Vesty, M.C, Dobson, R.C.J.
登録日2023-07-05
公開日2024-07-10
最終更新日2024-10-02
実験手法X-RAY DIFFRACTION (1.25 Å)
主引用文献Crystal structure of an isethionate substrate-binding protein (IseP) bound to isethionate
To Be Published
6JWN
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BU of 6jwn by Molmil
Crystal structure of the SPRY domain of SPSB2 in complex with cR9, a cyclic peptide inhibitor of SPSB-iNOS interaction
分子名称: Nitric oxide synthase, inducible, SPRY domain-containing SOCS box protein 2
著者Li, K, Kuang, Z.
登録日2019-04-21
公開日2020-04-22
最終更新日2024-03-27
実験手法X-RAY DIFFRACTION (1.61 Å)
主引用文献Crystal structure of SPSB2 in complex with cR9, a cyclic peptide inhibitor of SPSB-iNOS interaction
To Be Published
7M3R
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BU of 7m3r by Molmil
Crystallographic Structure of the Rhombohedral Crystal Form of STMV Grown from Bromide
分子名称: BROMIDE ION, Coat protein, MAGNESIUM ION
著者McPherson, A.
登録日2021-03-18
公開日2021-12-15
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Structures of additional crystal forms of Satellite tobacco mosaic virus grown from a variety of salts.
Acta Crystallogr.,Sect.F, 77, 2021
6CB0
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BU of 6cb0 by Molmil
Crystal Structure of the FAK FERM domain
分子名称: Focal adhesion kinase 1
著者Dementiev, A, Marlowe, T.
登録日2018-02-01
公開日2019-02-06
最終更新日2023-10-04
実験手法X-RAY DIFFRACTION (1.97 Å)
主引用文献High resolution crystal structure of the FAK FERM domain reveals new insights on the Druggability of tyrosine 397 and the Src SH3 binding site.
BMC Mol Cell Biol, 20, 2019
7M3T
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BU of 7m3t by Molmil
Crystallographic structure of a cubic crystal of STMV (80.7 degree rotation about 111) grown from chloride
分子名称: CHLORIDE ION, Coat protein, MAGNESIUM ION, ...
著者McPherson, A.
登録日2021-03-19
公開日2021-12-15
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (3.2 Å)
主引用文献Structures of additional crystal forms of Satellite tobacco mosaic virus grown from a variety of salts.
Acta Crystallogr.,Sect.F, 77, 2021
8TAV
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BU of 8tav by Molmil
FphH, Staphylococcus aureus fluorophosphonate-binding serine hydrolases H, boronic acid-based compound N34 bound
分子名称: CALCIUM ION, Fluorophosphonate-binding serine hydrolase H, [5-(trifluoromethyl)thiophen-2-yl]boronic acid
著者Fellner, M.
登録日2023-06-28
公開日2024-07-17
実験手法X-RAY DIFFRACTION (1.39 Å)
主引用文献FphH, Staphylococcus aureus fluorophosphonate-binding serine hydrolases H, boronic acid-based compound N34 bound
To Be Published

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件を2024-11-06に公開中

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