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7R5E
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FtrA-P19 from Rubrivivax gelatinosus in complex with copper and magnesium (X1)
分子名称: COPPER (II) ION, DI(HYDROXYETHYL)ETHER, FtrA-P19, ...
著者Morera, S, Vigouroux, A.
登録日2022-02-10
公開日2022-05-18
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献New insights into the mechanism of iron transport through the bacterial Ftr system present in pathogens.
Febs J., 289, 2022
6Z9W
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Human Class I Major Histocompatibility Complex, A02 allele, presenting LLGWVFAQV
分子名称: Beta-2-microglobulin, LEU-LEU-GLY-TRP-VAL-PHE-ALA-GLN-VAL, MHC class I antigen
著者Rizkallah, P.J, Man, S, Redman, J.E.
登録日2020-06-04
公開日2021-06-30
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (2.7 Å)
主引用文献Synthetic Peptides with Inadvertent Chemical Modifications Can Activate Potentially Autoreactive T Cells.
J Immunol., 207, 2021
3FUX
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T. thermophilus 16S rRNA A1518 and A1519 methyltransferase (KsgA) in complex with 5'-methylthioadenosine in space group P212121
分子名称: 5'-DEOXY-5'-METHYLTHIOADENOSINE, Dimethyladenosine transferase
著者Demirci, H, Belardinelli, R, Seri, E, Gregory, S.T, Gualerzi, C, Dahlberg, A.E, Jogl, G.
登録日2009-01-14
公開日2009-03-31
最終更新日2024-02-21
実験手法X-RAY DIFFRACTION (1.68 Å)
主引用文献Structural rearrangements in the active site of the Thermus thermophilus 16S rRNA methyltransferase KsgA in a binary complex with 5'-methylthioadenosine.
J.Mol.Biol., 388, 2009
7R4V
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BU of 7r4v by Molmil
Strep-tag FtrA-P19 from Rubrivivax gelatinosus in complex with an endogenous CU1
分子名称: COPPER (I) ION, FtrA-P19
著者Morera, S, Vigouroux, A.
登録日2022-02-09
公開日2022-05-18
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (1.3 Å)
主引用文献New insights into the mechanism of iron transport through the bacterial Ftr system present in pathogens.
Febs J., 289, 2022
7R3S
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BU of 7r3s by Molmil
FtrA/P19 of Rubrivivax gelatinosus in complex with Ni
分子名称: FtrA-P19 protein, GLYCEROL, NICKEL (II) ION, ...
著者Morera, S, Vigouroux, A.
登録日2022-02-07
公開日2022-05-18
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (1.79 Å)
主引用文献New insights into the mechanism of iron transport through the bacterial Ftr system present in pathogens.
Febs J., 289, 2022
3FWA
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BU of 3fwa by Molmil
Structure of berberine bridge enzyme, C166A variant in complex with (S)-reticuline
分子名称: (S)-reticuline, 2-acetamido-2-deoxy-beta-D-glucopyranose, FLAVIN-ADENINE DINUCLEOTIDE, ...
著者Winkler, A, Macheroux, P, Gruber, K.
登録日2009-01-17
公開日2009-05-19
最終更新日2023-09-06
実験手法X-RAY DIFFRACTION (1.496 Å)
主引用文献Structural roles of biocovalent flaninylation in berberine bridge enzyme
to be published
3FWV
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BU of 3fwv by Molmil
Crystal Structure of a Redesigned TPR Protein, T-MOD(VMY), in Complex with MEEVF Peptide
分子名称: Heat shock protein HSP 90-beta, Hsc70/Hsp90-organizing protein, NICKEL (II) ION
著者Jackrel, M.E, Valverde, R, Regan, L.
登録日2009-01-19
公開日2009-04-21
最終更新日2021-10-20
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Redesign of a protein-peptide interaction: characterization and applications
Protein Sci., 18, 2009
6YVK
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BU of 6yvk by Molmil
Human OMPD-domain of UMPS in complex with the substrate OMP at 1.25 Angstroms resolution, 0.71 MGy exposure
分子名称: GLYCEROL, OROTIDINE-5'-MONOPHOSPHATE, SULFATE ION, ...
著者Tittmann, K, Rindfleisch, S, Krull, M.
登録日2020-04-28
公開日2021-11-17
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (1.25 Å)
主引用文献Ground-state destabilization by electrostatic repulsion is not a driving force in orotidine-5-monophosphate decarboxylase catalysis
Nat Catal, 5, 2022
6QJK
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Crystal Structure of the third PDZ domain of PSD-95 protein D332G mutant: space group P43
分子名称: Disks large homolog 4, GLYCEROL, SULFATE ION
著者Camara-Artigas, A.
登録日2019-01-24
公開日2019-04-17
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (1.046 Å)
主引用文献Conformational changes in the third PDZ domain of the neuronal postsynaptic density protein 95.
Acta Crystallogr D Struct Biol, 75, 2019
6YVL
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BU of 6yvl by Molmil
Human OMPD-domain of UMPS in complex with the substrate OMP at 1.25 Angstroms resolution, 1.42 MGy exposure
分子名称: GLYCEROL, OROTIDINE-5'-MONOPHOSPHATE, SULFATE ION, ...
著者Tittmann, K, Rindfleisch, S, Krull, M.
登録日2020-04-28
公開日2021-11-17
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (1.25 Å)
主引用文献Ground-state destabilization by electrostatic repulsion is not a driving force in orotidine-5-monophosphate decarboxylase catalysis
Nat Catal, 5, 2022
6YVN
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Human OMPD-domain of UMPS in complex with the substrate OMP at 1.25 Angstroms resolution, 2.84 MGy exposure
分子名称: GLYCEROL, OROTIDINE-5'-MONOPHOSPHATE, SULFATE ION, ...
著者Tittmann, K, Rindfleisch, S, Krull, M.
登録日2020-04-28
公開日2021-11-17
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (1.25 Å)
主引用文献Ground-state destabilization by electrostatic repulsion is not a driving force in orotidine-5-monophosphate decarboxylase catalysis
Nat Catal, 5, 2022
7RAD
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BU of 7rad by Molmil
Crystal Structure Analysis of ALDH1B1
分子名称: 1,2-ETHANEDIOL, 3-(2-methoxyphenyl)-1-(4-phenylphenyl)-6,7,8,9-tetrahydro-5~{H}-imidazo[1,2-a][1,3]diazepine, Aldehyde dehydrogenase X, ...
著者Fernandez, D, Chen, J.K.
登録日2021-07-01
公開日2022-06-08
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Inhibitors targeted to aldehyde dehydrogenase
Nat.Chem.Biol., 2022
6YWU
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BU of 6ywu by Molmil
Human OMPD-domain of UMPS (K314AcK) in complex with UMP at 1.1 Angstroms resolution
分子名称: GLYCEROL, SULFATE ION, URIDINE-5'-MONOPHOSPHATE, ...
著者Tittmann, K, Rindfleisch, S, Krull, M.
登録日2020-04-30
公開日2022-02-23
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (1.1 Å)
主引用文献Ground-state destabilization by electrostatic repulsion is not a driving force in orotidine-5-monophosphate decarboxylase catalysis
Nat Catal, 5, 2022
6YVO
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BU of 6yvo by Molmil
Human OMPD-domain of UMPS in complex with the substrate OMP at 1.25 Angstroms resolution, 3.55 MGy exposure
分子名称: GLYCEROL, OROTIDINE-5'-MONOPHOSPHATE, SULFATE ION, ...
著者Tittmann, K, Rindfleisch, S, Krull, M.
登録日2020-04-28
公開日2022-02-23
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (1.25 Å)
主引用文献Ground-state destabilization by electrostatic repulsion is not a driving force in orotidine-5-monophosphate decarboxylase catalysis
Nat Catal, 5, 2022
3FY4
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BU of 3fy4 by Molmil
(6-4) Photolyase Crystal Structure
分子名称: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, 6-4 photolyase, FLAVIN-ADENINE DINUCLEOTIDE, ...
著者Hitomi, K, Arvai, A.S, Tainer, J.A, Getzoff, E.D.
登録日2009-01-21
公開日2009-04-28
最終更新日2024-02-21
実験手法X-RAY DIFFRACTION (2.7 Å)
主引用文献Functional motifs in the (6-4) photolyase crystal structure make a comparative framework for DNA repair photolyases and clock cryptochromes.
Proc.Natl.Acad.Sci.USA, 106, 2009
3FZ6
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BU of 3fz6 by Molmil
Crystal structure of glutamate decarboxylase beta from Escherichia coli: complex with xenon
分子名称: 4'-DEOXY-4'-AMINOPYRIDOXAL-5'-PHOSPHATE, Glutamate decarboxylase beta, XENON
著者Malashkevich, V.N, De Biase, D, Bossa, F.
登録日2009-01-23
公開日2009-02-03
最終更新日2024-02-21
実験手法X-RAY DIFFRACTION (2.82 Å)
主引用文献Crystal structure of glutamate decarboxylase beta from Escherichia coli: complex with xenon
To be Published
3N3B
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BU of 3n3b by Molmil
Ribonucleotide Reductase Dimanganese(II)-NrdF from Escherichia coli in Complex with Reduced NrdI with a Trapped Peroxide
分子名称: FLAVIN MONONUCLEOTIDE, HYDROGEN PEROXIDE, MANGANESE (II) ION, ...
著者Boal, A.K, Cotruvo Jr, J.A, Stubbe, J, Rosenzweig, A.C.
登録日2010-05-19
公開日2010-08-18
最終更新日2023-09-06
実験手法X-RAY DIFFRACTION (2.36 Å)
主引用文献Structural basis for activation of class Ib ribonucleotide reductase.
Science, 329, 2010
3N4D
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BU of 3n4d by Molmil
Crystal structure of Cg10062 inactivated by(R)-oxirane-2-carboxylate
分子名称: Putative tautomerase
著者Guo, Y, Robertson, B.A, Hackert, M.L, Whitman, C.P.
登録日2010-05-21
公開日2011-06-01
最終更新日2023-09-06
実験手法X-RAY DIFFRACTION (2.54 Å)
主引用文献Crystal Structures of the Native and Inactivated Cg10062, a cis-3-Chloroacrylic Acid Dehalogenase from Corynebacterium glutamicum: Implications for the Evolution of cis-3-Chloroacrylic Acid Dehalogenase Activity in the Tautomerase Superfamily
To be Published
6QLM
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BU of 6qlm by Molmil
Cathepsin-K in complex with MIV-701
分子名称: (CARBAMOYLMETHYL-CARBOXYMETHYL-AMINO)-ACETIC ACID, Cathepsin K, GLYCEROL, ...
著者Derbyshire, D.J.
登録日2019-02-01
公開日2020-02-19
実験手法X-RAY DIFFRACTION (1.5 Å)
主引用文献Successful development of 3-oxohexahydrofuropyrrole amino acid amides as inhibitors of Cathepsin-K.
To Be Published
6QM0
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BU of 6qm0 by Molmil
Cathepsin-K in complex with amino-oxaazabicyclo[3.3.0]octanyl containing inhibitor
分子名称: (CARBAMOYLMETHYL-CARBOXYMETHYL-AMINO)-ACETIC ACID, Cathepsin K, ~{N}-[(2~{S})-1-[(3~{R},3~{a}~{R},6~{R},6~{a}~{R})-6-azanyl-3-oxidanyl-2,3,3~{a},5,6,6~{a}-hexahydrofuro[3,2-b]pyrrol-4-yl]-4-methyl-1-oxidanylidene-pentan-2-yl]-3-fluoranyl-4-[2-(4-methylpiperazin-1-yl)-1,3-thiazol-4-yl]benzamide
著者Derbyshire, D.J.
登録日2019-02-01
公開日2020-02-19
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Successful development of 3-oxohexahydrofuropyrrole amino acid amides as inhibitors of Cathepsin-K.
To Be Published
3NM1
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BU of 3nm1 by Molmil
The Crystal Structure of Candida glabrata THI6, a Bifunctional Enzyme involved in Thiamin Biosyhthesis of Eukaryotes
分子名称: 2-TRIFLUOROMETHYL-5-METHYLENE-5H-PYRIMIDIN-4-YLIDENEAMINE, 4-methyl-5-[2-(phosphonooxy)ethyl]-1,3-thiazole-2-carboxylic acid, MAGNESIUM ION, ...
著者Paul, D, Chatterjee, A, Begley, T.P, Ealick, S.E.
登録日2010-06-21
公開日2010-11-10
最終更新日2024-02-21
実験手法X-RAY DIFFRACTION (3.211 Å)
主引用文献Domain Organization in Candida glabrata THI6, a Bifunctional Enzyme Required for Thiamin Biosynthesis in Eukaryotes .
Biochemistry, 49, 2010
3FZ8
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BU of 3fz8 by Molmil
Crystal structure of glutamate decarboxylase beta from Escherichia coli: reduced Schiff base with PLP
分子名称: (5-HYDROXY-4,6-DIMETHYLPYRIDIN-3-YL)METHYL DIHYDROGEN PHOSPHATE, Glutamate decarboxylase beta
著者Malashkevich, V.N, De Biase, D, Bossa, F.
登録日2009-01-23
公開日2009-02-03
最終更新日2017-11-01
実験手法X-RAY DIFFRACTION (3 Å)
主引用文献Crystal structure of glutamate decarboxylase beta from Escherichia coli: reduced Schiff base with PLP
to be published
3OWQ
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BU of 3owq by Molmil
X-Ray Structure of Lin1025 protein from Listeria innocua, Northeast Structural Genomics Consortium Target LkR164
分子名称: DI(HYDROXYETHYL)ETHER, Lin1025 protein
著者Kuzin, A, Su, M, Lew, S, Seetharaman, J, Patel, P, Xiao, R, Ciccosanti, C, Lee, D, Everett, J.K, Nair, R, Acton, T.B, Rost, B, Montelione, G.T, Hunt, J.F, Tong, L, Northeast Structural Genomics Consortium (NESG)
登録日2010-09-20
公開日2010-10-20
最終更新日2012-02-22
実験手法X-RAY DIFFRACTION (2.606 Å)
主引用文献Northeast Structural Genomics Consortium Target LkR164
To be published
3OX9
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BU of 3ox9 by Molmil
Crystal Structure of Ketosteroid Isomerase D40N/C69S/C81S/C97S/F86C-CN from P. putida
分子名称: Steroid Delta-isomerase
著者Sigala, P.A, Fenn, T.D, Herschlag, D.
登録日2010-09-21
公開日2011-09-21
最終更新日2023-12-06
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Quantitative, directional measurement of electric field heterogeneity in the active site of ketosteroid isomerase.
Proc.Natl.Acad.Sci.USA, 109, 2012
3FUW
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BU of 3fuw by Molmil
T. thermophilus 16S rRNA A1518 and A1519 methyltransferase (KsgA) in complex with 5'-methylthioadenosine in space group P212121
分子名称: 5'-DEOXY-5'-METHYLTHIOADENOSINE, Dimethyladenosine transferase
著者Demirci, H, Belardinelli, R, Seri, E, Gregory, S.T, Gualerzi, C, Dahlberg, A.E, Jogl, G.
登録日2009-01-14
公開日2009-03-31
最終更新日2024-02-21
実験手法X-RAY DIFFRACTION (1.56 Å)
主引用文献Structural rearrangements in the active site of the Thermus thermophilus 16S rRNA methyltransferase KsgA in a binary complex with 5'-methylthioadenosine.
J.Mol.Biol., 388, 2009

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