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6QGA
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BU of 6qga by Molmil
Crystal structure of Ideonella sakaiensis MHETase bound to the non-hydrolyzable ligand MHETA
分子名称: (4S)-2-METHYL-2,4-PENTANEDIOL, 4-(2-hydroxyethylcarbamoyl)benzoic acid, CALCIUM ION, ...
著者Palm, G.J, Reisky, L, Boettcher, D, Mueller, H, Michels, E.A.P, Walczak, C, Berndt, L, Weiss, M.S, Bornscheuer, U.T, Weber, G.
登録日2019-01-10
公開日2019-04-03
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Structure of the plastic-degrading Ideonella sakaiensis MHETase bound to a substrate.
Nat Commun, 10, 2019
2VK8
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BU of 2vk8 by Molmil
Crystal structure of the Saccharomyces cerevisiae pyruvate decarboxylase variant E477Q in complex with its substrate
分子名称: (2S)-2-HYDROXYPROPANOIC ACID, MAGNESIUM ION, PYRUVATE DECARBOXYLASE ISOZYME 1, ...
著者Kutter, S, Weik, M, Weiss, M.S, Konig, S.
登録日2007-12-17
公開日2009-01-27
最終更新日2023-12-13
実験手法X-RAY DIFFRACTION (1.42 Å)
主引用文献Covalently Bound Substrate at the Regulatory Site of Yeast Pyruvate Decarboxylases Triggers Allosteric Enzyme Activation.
J.Biol.Chem., 284, 2009
3FSY
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BU of 3fsy by Molmil
Structure of tetrahydrodipicolinate N-succinyltransferase (Rv1201c;DapD) in complex with succinyl-CoA from Mycobacterium tuberculosis
分子名称: (4S)-2-METHYL-2,4-PENTANEDIOL, ACETIC ACID, MAGNESIUM ION, ...
著者Schuldt, L, Weyand, S, Kefala, G, Weiss, M.S.
登録日2009-01-12
公開日2009-06-23
最終更新日2024-02-21
実験手法X-RAY DIFFRACTION (1.97 Å)
主引用文献The three-dimensional Structure of a mycobacterial DapD provides insights into DapD diversity and reveals unexpected particulars about the enzymatic mechanism.
J.Mol.Biol., 389, 2009
2VK1
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BU of 2vk1 by Molmil
Crystal structure of the Saccharomyces cerevisiae pyruvate decarboxylase variant D28A in complex with its substrate
分子名称: MAGNESIUM ION, PYRUVATE DECARBOXYLASE ISOZYME 1, PYRUVIC ACID, ...
著者Kutter, S, Weik, M, Weiss, M.S, Konig, S.
登録日2007-12-16
公開日2009-01-27
最終更新日2023-12-13
実験手法X-RAY DIFFRACTION (1.71 Å)
主引用文献Covalently Bound Substrate at the Regulatory Site of Yeast Pyruvate Decarboxylases Triggers Allosteric Enzyme Activation.
J.Biol.Chem., 284, 2009
2YIL
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BU of 2yil by Molmil
Crystal Structure of Parasite Sarcocystis muris Lectin SML-2
分子名称: CHLORIDE ION, GLYCEROL, MICRONEME ANTIGEN L2, ...
著者Mueller, J.J, Weiss, M.S, Heinemann, U.
登録日2011-05-16
公開日2011-11-02
最終更新日2019-07-17
実験手法X-RAY DIFFRACTION (1.95 Å)
主引用文献Pan-Modular Structure of Microneme Protein Sml-2 from Parasite Sarcocystis Muris at 1.95 A Resolution and its Complex with 1-Thio-Beta-D-Galactose.
Acta Crystallogr.,Sect.D, D67, 2011
3FSX
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BU of 3fsx by Molmil
Structure of tetrahydrodipicolinate N-succinyltransferase (Rv1201c; DapD) from Mycobacterium tuberculosis
分子名称: (4S)-2-METHYL-2,4-PENTANEDIOL, ACETIC ACID, MAGNESIUM ION, ...
著者Schuldt, L, Weyand, S, Kefala, G, Weiss, M.S.
登録日2009-01-12
公開日2009-06-23
最終更新日2024-02-21
実験手法X-RAY DIFFRACTION (2.15 Å)
主引用文献The three-dimensional Structure of a mycobacterial DapD provides insights into DapD diversity and reveals unexpected particulars about the enzymatic mechanism.
J.Mol.Biol., 389, 2009
2XYO
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BU of 2xyo by Molmil
Structural basis for a new tetracycline resistance mechanism relying on the TetX monooxygenase
分子名称: FLAVIN-ADENINE DINUCLEOTIDE, GLYCEROL, SULFATE ION, ...
著者Volkers, G, Palm, G.J, Weiss, M.S, Hinrichs, W.
登録日2010-11-18
公開日2011-03-23
最終更新日2019-07-17
実験手法X-RAY DIFFRACTION (3 Å)
主引用文献Structural Basis for a New Tetracycline Resistance Mechanism Relying on the Tetx Monooxygenase.
FEBS Lett., 585, 2011
3HFW
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BU of 3hfw by Molmil
Crystal Structure of human ADP-ribosylhydrolase 1 (hARH1)
分子名称: ADENOSINE-5'-DIPHOSPHATE, CHLORIDE ION, MAGNESIUM ION, ...
著者Mueller-Dieckmann, C, Weiss, M.S, Mueller-Dieckmann, J, Koch-Nolte, F.
登録日2009-05-13
公開日2010-05-26
最終更新日2024-02-21
実験手法X-RAY DIFFRACTION (1.92 Å)
主引用文献Crystal Structure of human ADP-ribosylhydrolase 1
To be Published
1JCV
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BU of 1jcv by Molmil
REDUCED BRIDGE-BROKEN YEAST CU/ZN SUPEROXIDE DISMUTASE LOW TEMPERATURE (-180C) STRUCTURE
分子名称: COPPER (II) ION, CU/ZN SUPEROXIDE DISMUTASE, ZINC ION
著者Ogihara, N.L, Parge, H.E, Hart, P.J, Weiss, M.S, Valentine, J.S, Eisenberg, D.S, Tainer, J.A.
登録日1995-12-07
公開日1996-03-08
最終更新日2024-06-05
実験手法X-RAY DIFFRACTION (1.55 Å)
主引用文献Unusual trigonal-planar copper configuration revealed in the atomic structure of yeast copper-zinc superoxide dismutase.
Biochemistry, 35, 1996
8PH4
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BU of 8ph4 by Molmil
Co-Crystal structure of the SARS-CoV2 main protease Nsp5 with an Uracil-carrying X77-like inhibitor
分子名称: 3C-like proteinase nsp5, DIMETHYL SULFOXIDE, MALONATE ION, ...
著者Barthel, T, Altincekic, N, Jores, N, Wollenhaupt, J, Weiss, M.S, Schwalbe, H.
登録日2023-06-18
公開日2024-01-31
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (1.69 Å)
主引用文献Targeting the Main Protease (M pro , nsp5) by Growth of Fragment Scaffolds Exploiting Structure-Based Methodologies.
Acs Chem.Biol., 19, 2024
6TTN
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BU of 6ttn by Molmil
N-terminally truncated hyoscyamine 6-hydroxylase (tH6H) in complex with N-oxalylglycine and hyoscyamine
分子名称: 1,2-ETHANEDIOL, Hyoscyamine 6 beta-hydroxylase, N-OXALYLGLYCINE, ...
著者Kluza, A, Mrugala, B, Porebski, P.J, Kurpiewska, K, Niedzialkowska, E, Weiss, M.S, Borowski, T.
登録日2019-12-29
公開日2020-03-18
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (1.12 Å)
主引用文献Regioselectivity of hyoscyamine 6 beta-hydroxylase-catalysed hydroxylation as revealed by high-resolution structural information and QM/MM calculations.
Dalton Trans, 49, 2020
6TTO
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BU of 6tto by Molmil
N-terminally truncated hyoscyamine 6-hydroxylase (tH6H) in complex with 2-oxoglutarate
分子名称: 1,2-ETHANEDIOL, 2-OXOGLUTARIC ACID, FORMIC ACID, ...
著者Kluza, A, Mrugala, B, Porebski, P.J, Kurpiewska, K, Niedzialkowska, E, Weiss, M.S, Borowski, T.
登録日2019-12-29
公開日2020-03-18
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (1.31 Å)
主引用文献Regioselectivity of hyoscyamine 6 beta-hydroxylase-catalysed hydroxylation as revealed by high-resolution structural information and QM/MM calculations.
Dalton Trans, 49, 2020
6TC2
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BU of 6tc2 by Molmil
Monoclinic human insulin in complex with p-coumaric acid
分子名称: 4'-HYDROXYCINNAMIC ACID, Insulin, PHOSPHATE ION, ...
著者Triandafillidis, D.-P, Parthenios, N, Spiliopoulou, M, Valmas, A, Kosinas, C, Gozzo, F, Reinle-Schmitt, M, Beckers, D, Degen, T, Pop, M, Fitch, A, Wollenhaupt, J, Weiss, M.S, Karavassili, F, Margiolaki, I.
登録日2019-11-04
公開日2020-11-11
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (1.36 Å)
主引用文献Insulin polymorphism induced by two polyphenols: new crystal forms and advances in macromolecular powder diffraction.
Acta Crystallogr D Struct Biol, 76, 2020
2ILL
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BU of 2ill by Molmil
Anomalous substructure of Titin-A168169
分子名称: CHLORIDE ION, Titin
著者Mueller-Dieckmann, C, Weiss, M.S.
登録日2006-10-03
公開日2007-02-20
最終更新日2024-03-13
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献On the routine use of soft X-rays in macromolecular crystallography. Part IV. Efficient determination of anomalous substructures in biomacromolecules using longer X-ray wavelengths
ACTA CRYSTALLOGR.,SECT.D, 63, 2007
7QG7
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BU of 7qg7 by Molmil
SARS-CoV-2 macrodomain Nsp3b bound to the remdesivir nucleoside GS-441524
分子名称: (2~{R},3~{R},4~{S},5~{R})-2-(4-azanylpyrrolo[2,1-f][1,2,4]triazin-7-yl)-5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolane-2-carbonitrile, 1,2-ETHANEDIOL, Papain-like protease nsp3
著者Wollenhaupt, J, Linhard, V, Sreeramulu, S, Weiss, M.S, Schwalbe, H.
登録日2021-12-07
公開日2021-12-15
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (1.72 Å)
主引用文献Binding Adaptation of GS-441524 Diversifies Macro Domains and Downregulates SARS-CoV-2 de-MARylation Capacity.
J.Mol.Biol., 434, 2022
1YL6
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BU of 1yl6 by Molmil
crystal structure of Mycobacterium tuberculosis dihydrodipicolinate reductase (Rv2773c) (crystal form B)
分子名称: Dihydrodipicolinate reductase, MAGNESIUM ION
著者Janowski, R, Kefala, G, Weiss, M.S, TB Structural Genomics Consortium (TBSGC)
登録日2005-01-19
公開日2006-01-17
最終更新日2023-08-23
実験手法X-RAY DIFFRACTION (2.9 Å)
主引用文献The structure of dihydrodipicolinate reductase (DapB) from Mycobacterium tuberculosis in three crystal forms.
Acta Crystallogr.,Sect.D, 66, 2010
1YL5
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BU of 1yl5 by Molmil
Crystal structure of Mycobacterium tuberculosis dihydrodipicolinate reductase (RV2773C) (crystal form A)
分子名称: Dihydrodipicolinate reductase, MAGNESIUM ION
著者Janowski, R, Kefala, G, Weiss, M.S, TB Structural Genomics Consortium (TBSGC)
登録日2005-01-19
公開日2006-01-17
最終更新日2023-08-23
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献The structure of dihydrodipicolinate reductase (DapB) from Mycobacterium tuberculosis in three crystal forms.
Acta Crystallogr.,Sect.D, 66, 2010
2A5W
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BU of 2a5w by Molmil
Crystal structure of the oxidized gamma-subunit of the dissimilatory sulfite reductase (DsrC) from Archaeoglobus fulgidus
分子名称: SULFATE ION, sulfite reductase, desulfoviridin-type subunit gamma (dsvC)
著者Mander, G.J, Weiss, M.S, Hedderich, R, Kahnt, J, Ermler, U, Warkentin, E.
登録日2005-07-01
公開日2005-09-06
最終更新日2023-08-23
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献X-ray structure of the gamma-subunit of a dissimilatory sulfite reductase: Fixed and flexible C-terminal arms.
Febs Lett., 579, 2005
2A7C
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BU of 2a7c by Molmil
On the Routine Use of Soft X-Rays in Macromolecular Crystallography, Part III- The Optimal Data Collection Wavelength
分子名称: Elastase 1, GLYCEROL, SULFATE ION, ...
著者Mueller-Dieckmann, C, Panjikar, S, Tucker, P.A, Weiss, M.S.
登録日2005-07-05
公開日2005-07-19
最終更新日2011-07-13
実験手法X-RAY DIFFRACTION (1.65 Å)
主引用文献On the routine use of soft X-rays in macromolecular crystallography. Part III. The optimal data-collection wavelength.
Acta Crystallogr.,Sect.D, 61, 2005
2A7E
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BU of 2a7e by Molmil
On the Routine Use of Soft X-Rays in Macromolecular Crystallography, Part III- The Optimal Data Collection Wavelength
分子名称: DNA (5'-D(*CP*CP*CP*TP*AP*GP*GP*G)-3')
著者Mueller-Dieckmann, C, Panjikar, S, Tucker, P.A, Weiss, M.S.
登録日2005-07-05
公開日2005-07-19
最終更新日2024-02-14
実験手法X-RAY DIFFRACTION (1.66 Å)
主引用文献On the routine use of soft X-rays in macromolecular crystallography. Part III. The optimal data-collection wavelength.
Acta Crystallogr.,Sect.D, 61, 2005
2A7F
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BU of 2a7f by Molmil
On the Routine Use of Soft X-Rays in Macromolecular Crystallography, Part III- The Optimal Data Collection Wavelength
分子名称: CHLORIDE ION, Lysozyme C, SODIUM ION
著者Mueller-Dieckmann, C, Panjikar, S, Tucker, P.A, Weiss, M.S.
登録日2005-07-05
公開日2005-07-19
最終更新日2011-07-13
実験手法X-RAY DIFFRACTION (1.85 Å)
主引用文献On the routine use of soft X-rays in macromolecular crystallography. Part III. The optimal data-collection wavelength.
Acta Crystallogr.,Sect.D, 61, 2005
2A7D
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BU of 2a7d by Molmil
On the Routine Use of Soft X-Rays in Macromolecular Crystallography, Part III- The Optimal Data Collection Wavelength
分子名称: CHLORIDE ION, Lysozyme C, SODIUM ION, ...
著者Mueller-Dieckmann, C, Panjikar, S, Tucker, P.A, Weiss, M.S.
登録日2005-07-05
公開日2005-07-19
最終更新日2011-07-13
実験手法X-RAY DIFFRACTION (1.66 Å)
主引用文献On the routine use of soft X-rays in macromolecular crystallography. Part III. The optimal data-collection wavelength.
Acta Crystallogr.,Sect.D, 61, 2005
2A7A
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BU of 2a7a by Molmil
On the Routine Use of Soft X-Rays in Macromolecular Crystallography, Part III- The Optimal Data Collection Wavelength
分子名称: CALCIUM ION, Concanavalin A, MANGANESE (II) ION, ...
著者Mueller-Dieckmann, C, Panjikar, S, Tucker, P.A, Weiss, M.S.
登録日2005-07-05
公開日2005-07-19
最終更新日2024-02-14
実験手法X-RAY DIFFRACTION (1.75 Å)
主引用文献On the routine use of soft X-rays in macromolecular crystallography. Part III. The optimal data-collection wavelength.
Acta Crystallogr.,Sect.D, 61, 2005
2A7J
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BU of 2a7j by Molmil
On the Routine Use of Soft X-Rays in Macromolecular Crystallography, Part III- The Optimal Data Collection Wavelength
分子名称: ACETATE ION, CALCIUM ION, CHLORIDE ION, ...
著者Mueller-Dieckmann, C, Panjikar, S, Tucker, P.A, Weiss, M.S.
登録日2005-07-05
公開日2005-07-19
最終更新日2024-10-16
実験手法X-RAY DIFFRACTION (1.65 Å)
主引用文献On the routine use of soft X-rays in macromolecular crystallography. Part III. The optimal data-collection wavelength.
Acta Crystallogr.,Sect.D, 61, 2005
2A7H
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BU of 2a7h by Molmil
On the Routine Use of Soft X-Rays in Macromolecular Crystallography, Part III- The Optimal Data Collection Wavelength
分子名称: CALCIUM ION, CHLORIDE ION, Cationic trypsin
著者Mueller-Dieckmann, C, Panjikar, S, Tucker, P.A, Weiss, M.S.
登録日2005-07-05
公開日2005-07-19
最終更新日2011-07-13
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献On the routine use of soft X-rays in macromolecular crystallography. Part III. The optimal data-collection wavelength.
Acta Crystallogr.,Sect.D, 61, 2005

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