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2W3T
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BU of 2w3t by Molmil
Chloro complex of the Ni-Form of E.coli deformylase
分子名称: CHLORIDE ION, ETHANOL, NICKEL (II) ION, ...
著者Ngo, Y.H.T, Palm, G.J, Hinrichs, W.
登録日2008-11-14
公開日2009-12-15
最終更新日2023-12-13
実験手法X-RAY DIFFRACTION (1.69 Å)
主引用文献Structure of the Ni(II) Complex of Escherichia Coli Peptide Deformylase and Suggestions on Deformylase Activities Depending on Different Metal(II) Centres.
J.Biol.Inorg.Chem., 15, 2010
2Y6Q
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BU of 2y6q by Molmil
Structure of the TetX monooxygenase in complex with the substrate 7- Iodtetracycline
分子名称: 7-IODOTETRACYCLINE, FLAVIN-ADENINE DINUCLEOTIDE, SULFATE ION, ...
著者Volkers, G, Palm, G.J, Weiss, M.S, Wright, G.D, Hinrichs, W.
登録日2011-01-25
公開日2011-03-23
最終更新日2023-12-20
実験手法X-RAY DIFFRACTION (2.37 Å)
主引用文献Structural Basis for a New Tetracycline Resistance Mechanism Relying on the Tetx Monooxygenase.
FEBS Lett., 585, 2011
2Y6R
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BU of 2y6r by Molmil
Structure of the TetX monooxygenase in complex with the substrate 7- chlortetracycline
分子名称: 7-CHLOROTETRACYCLINE, FLAVIN-ADENINE DINUCLEOTIDE, SULFATE ION, ...
著者Volkers, G, Palm, G.J, Weiss, M.S, Wright, G.D, Hinrichs, W.
登録日2011-01-25
公開日2011-03-23
最終更新日2023-12-20
実験手法X-RAY DIFFRACTION (3.1 Å)
主引用文献Structural Basis for a New Tetracycline Resistance Mechanism Relying on the Tetx Monooxygenase.
FEBS Lett., 585, 2011
2YH2
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BU of 2yh2 by Molmil
Pyrobaculum calidifontis esterase monoclinic form
分子名称: ESTERASE, SULFATE ION
著者Palm, G.J, Bogdanovic, X, Hinrichs, W.
登録日2011-04-27
公開日2011-05-18
最終更新日2023-12-20
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献The Crystal Structure of an Esterase Fom the Hyperthermophilic Microorganism Pyrobaculum Calidifontis Va1 Supports Explanation of its Enantioselectivity.
Appl.Microbiol.Biotechnol., 91, 2011
2XRL
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BU of 2xrl by Molmil
Tet-repressor class D T103A with doxycycline
分子名称: (4S,4AR,5S,5AR,6R,12AS)-4-(DIMETHYLAMINO)-3,5,10,12,12A-PENTAHYDROXY-6-METHYL-1,11-DIOXO-1,4,4A,5,5A,6,11,12A-OCTAHYDROTETRACENE-2-CARBOXAMIDE, CHLORIDE ION, MAGNESIUM ION, ...
著者Palm, G.J, Waack, P, Hinrichs, W.
登録日2010-09-16
公開日2011-10-05
最終更新日2023-12-20
実験手法X-RAY DIFFRACTION (1.85 Å)
主引用文献Thermodynamics, cooperativity and stability of the tetracycline repressor (TetR) upon tetracycline binding.
Biochim Biophys Acta Proteins Proteom, 1868, 2020
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
2X6O
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BU of 2x6o by Molmil
Tet Repressor class D in complex with 7-chlor-2-cyano-iso- tetracycline
分子名称: (4S,4AS,6S,8AS)-6-[(1S)-7-CHLORO-4-HYDROXY-1-METHYL-3-OXO-1,3-DIHYDRO-2-BENZOFURAN-1-YL]-4-(DIMETHYLAMINO)-3,8A-DIHYDROXY-1,8-DIOXO-1,4,4A,5,6,7,8,8A-OCTAHYDRONAPHTHALENE-2-CARBONITRILE, CHLORIDE ION, TETRACYCLINE REPRESSOR PROTEIN CLASS D
著者Volkers, G, Hinrichs, W.
登録日2010-02-18
公開日2011-03-02
最終更新日2023-12-20
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Recognition of Drug Degradation Products by Target Proteins: Isotetracycline Binding to Tet Repressor.
J.Med.Chem., 54, 2011
2WQ5
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BU of 2wq5 by Molmil
Non-antibiotic properties of tetracyclines: structural basis for inhibition of secretory phospholipase A2.
分子名称: (4S,4AS,5AR,12AS)-4,7-BIS(DIMETHYLAMINO)-3,10,12,12A-TETRAHYDROXY-1,11-DIOXO-1,4,4A,5,5A,6,11,12A-OCTAHYDROTETRACENE-2- CARBOXAMIDE, CALCIUM ION, PHOSPHOLIPASE A2, ...
著者Dalm, D, Palm, G.J, Hinrichs, W.
登録日2009-08-13
公開日2010-03-23
最終更新日2023-12-20
実験手法X-RAY DIFFRACTION (1.65 Å)
主引用文献Non-Antibiotic Properties of Tetracyclines: Structural Basis for Inhibition of Secretory Phospholipase A(2).
J.Mol.Biol., 398, 2010
7Q0Z
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BU of 7q0z by Molmil
Crystal structure of CTX-M-14
分子名称: Beta-lactamase, GLYCEROL, SULFATE ION
著者Werner, N, Perbandt, M, Hinrichs, W, Prester, A, Rohde, H, Aepfelbacher, M, Betzel, C.
登録日2021-10-17
公開日2022-04-13
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (1 Å)
主引用文献Structural basis to repurpose boron-based proteasome inhibitors Bortezomib and Ixazomib as beta-lactamase inhibitors.
Sci Rep, 12, 2022
7Q11
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BU of 7q11 by Molmil
Crystal structure of CTX-M-14 in complex with Ixazomib
分子名称: Beta-lactamase, CHLORIDE ION, DIMETHYL SULFOXIDE, ...
著者Werner, N, Perbandt, M, Hinrichs, W, Prester, A, Rohde, H, Aepfelbacher, M, Betzel, C.
登録日2021-10-17
公開日2022-04-13
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (1.14 Å)
主引用文献Structural basis to repurpose boron-based proteasome inhibitors Bortezomib and Ixazomib as beta-lactamase inhibitors.
Sci Rep, 12, 2022
7Q0Y
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BU of 7q0y by Molmil
Crystal structure of CTX-M-14 in complex with Bortezomib
分子名称: ACETATE ION, Beta-lactamase, CHLORIDE ION, ...
著者Werner, N, Perbandt, M, Hinrichs, W, Prester, A, Rohde, H, Aepfelbacher, M, Betzel, C.
登録日2021-10-17
公開日2022-04-13
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (1.3 Å)
主引用文献Structural basis to repurpose boron-based proteasome inhibitors Bortezomib and Ixazomib as beta-lactamase inhibitors.
Sci Rep, 12, 2022
7PXZ
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BU of 7pxz by Molmil
Reduced form of SARS-CoV-2 Main Protease determined by XFEL radiation
分子名称: 3C-like proteinase, CHLORIDE ION
著者Schubert, R, Reinke, P, Galchenkova, M, Oberthuer, D, Murillo, G.E.P, Kim, C, Bean, R, Turk, D, Hinrichs, W, Middendorf, P, Round, A, Schmidt, C, Mills, G, Kirkwood, H, Han, H, Koliyadu, J, Bielecki, J, Gelisio, L, Sikorski, M, Kloos, M, Vakilii, M, Yefanov, O.N, Vagovic, P, de-Wijn, R, Letrun, R, Guenther, S, White, T.A, Sato, T, Srinivasan, V, Kim, Y, Chretien, A, Han, S, Brognaro, H, Maracke, J, Knoska, J, Seychell, B.C, Brings, L, Norton-Baker, B, Geng, T, Dore, A.S, Uetrecht, C, Redecke, L, Beck, T, Lorenzen, K, Betzel, C, Mancuso, A.P, Bajt, S, Chapman, H.N, Meents, A, Lane, T.J.
登録日2021-10-08
公開日2023-01-18
最終更新日2024-05-01
実験手法X-RAY DIFFRACTION (1.75 Å)
主引用文献Reduced form of SARS-CoV-2 Main Protease determined by XFEL radiation
To Be Published
7PZQ
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BU of 7pzq by Molmil
Oxidized form of SARS-CoV-2 Main Protease determined by XFEL radiation
分子名称: 3C-like proteinase, DIMETHYL SULFOXIDE
著者Schubert, R, Reinke, P, Galchenkova, M, Oberthuer, D, Murillo, G.E.P, Kim, C, Bean, R, Turk, D, Hinrichs, W, Middendorf, P, Round, A, Schmidt, C, Mills, G, Kirkwood, H, Han, H, Koliyadu, J, Bielecki, J, Gelisio, L, Sikorski, M, Kloos, M, Vakilii, M, Yefanov, O.N, Vagovic, P, de-Wijn, R, Letrun, R, Guenther, S, White, T.A, Sato, T, Srinivasan, V, Kim, Y, Chretien, A, Han, S, Brognaro, H, Maracke, J, Knoska, J, Seychell, B.C, Brings, L, Norton-Baker, B, Geng, T, Dore, A.S, Uetrecht, C, Redecke, L, Beck, T, Lorenzen, K, Betzel, C, Mancuso, A.P, Bajt, S, Chapman, H.N, Meents, A, Lane, T.J.
登録日2021-10-13
公開日2023-01-25
最終更新日2024-05-01
実験手法X-RAY DIFFRACTION (2.25 Å)
主引用文献Oxidized form of SARS-CoV-2 Main Protease determined by XFEL radiation
To Be Published
4CHI
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BU of 4chi by Molmil
(R)-selective amine transaminase from Aspergillus fumigatus at 1.27 A resolution
分子名称: BRANCHED-CHAIN AMINO ACID AMINOTRANSFERASE, CHLORIDE ION, GLYCEROL, ...
著者Thomsen, M, Palm, G.J, Hinrichs, W.
登録日2013-12-02
公開日2014-04-30
最終更新日2017-10-18
実験手法X-RAY DIFFRACTION (1.27 Å)
主引用文献Crystallographic Characterization of the (R)-Selective Amine Transaminase from Aspergillus Fumigatus.
Acta Crystallogr.,Sect.D, 70, 2014
4D4F
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BU of 4d4f by Molmil
Mutant P250A of bacterial chalcone isomerase from Eubacterium ramulus
分子名称: CHALCONE ISOMERASE, CHLORIDE ION, GLYCEROL
著者Thomsen, M, Kratzat, H, Hinrichs, W.
登録日2014-10-28
公開日2016-01-20
最終更新日2023-12-20
実験手法X-RAY DIFFRACTION (2.34 Å)
主引用文献Structural Basis for (2 R ,3 R )-Taxifolin Binding and Reaction Products to the Bacterial Chalcone Isomerase of Eubacterium ramulus.
Molecules, 27, 2022
4CUO
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BU of 4cuo by Molmil
Banyan peroxidase with glycosylation
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, BANYAN PEROXIDASE, CALCIUM ION, ...
著者Palm, G.J, Sharma, A, Hinrichs, W.
登録日2014-03-20
公開日2014-07-23
最終更新日2023-11-15
実験手法X-RAY DIFFRACTION (1.67 Å)
主引用文献Post-Translational Modification and Extended Glycosylation Pattern of a Plant Latex Peroxidase of Native Source Characterized by X-Ray Crystallography.
FEBS J., 281, 2014
3ZPH
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BU of 3zph by Molmil
Bacterial chalcone isomerase in closed conformation from Eubacterium ramulus at 2.8 A resolution
分子名称: CHALCONE ISOMERASE, CHLORIDE ION, GLYCEROL
著者Thomsen, M, Palm, G.J, Hinrichs, W.
登録日2013-02-27
公開日2014-01-15
最終更新日2023-12-20
実験手法X-RAY DIFFRACTION (2.8 Å)
主引用文献Enzymatic conversion of flavonoids using bacterial chalcone isomerase and enoate reductase.
Angew.Chem.Int.Ed.Engl., 53, 2014
3ZWQ
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BU of 3zwq by Molmil
HYPERTHERMOPHILIC ESTERASE FROM THE ARCHEON PYROBACULUM CALIDIFONTIS
分子名称: ALPHA/BETA HYDROLASE FOLD-3 DOMAIN PROTEIN
著者Palm, G.J, Bogdanovic, X, Hinrichs, W.
登録日2011-08-02
公開日2011-08-17
最終更新日2023-12-20
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献The Crystal Structure of an Esterase from the Hyperthermophilic Microorganism Pyrobaculum Calidifontis Va1 Supports Explanation of its Enantioselectivity.
Appl.Microbiol.Biotechnol., 91, 2011
3ZPX
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BU of 3zpx by Molmil
USTILAGO MAYDIS LIPASE UM03410, SHORT FORM WITHOUT FLAP
分子名称: 1,2-ETHANEDIOL, DI(HYDROXYETHYL)ETHER, LIPASE, ...
著者Palm, G.J, Hinrichs, W.
登録日2013-03-04
公開日2014-03-19
最終更新日2023-12-20
実験手法X-RAY DIFFRACTION (1.99 Å)
主引用文献Lipase from Ustilago
To be Published
4ABZ
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BU of 4abz by Molmil
TetR(D) in Complex with Tigecycline and Magnesium, co-crystallized
分子名称: CHLORIDE ION, MAGNESIUM ION, TIGECYCLINE, ...
著者Volkers, G, Hinrichs, W.
登録日2011-12-12
公開日2012-12-26
最終更新日2023-12-20
実験手法X-RAY DIFFRACTION (1.886 Å)
主引用文献TetR(D) in Complex with Tigecycline and Magnesium
To be Published
4A5M
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BU of 4a5m by Molmil
Redox regulator HypR in its oxidized form
分子名称: 1,2-ETHANEDIOL, CHLORIDE ION, UNCHARACTERIZED HTH-TYPE TRANSCRIPTIONAL REGULATOR YYBR
著者Palm, G.J, Waack, P, Read, R.J, Hinrichs, W.
登録日2011-10-26
公開日2012-01-11
最終更新日2024-05-01
実験手法X-RAY DIFFRACTION (3 Å)
主引用文献Structural Insights Into the Redox-Switch Mechanism of the Marr/Duf24-Type Regulator Hypr
Nucleic Acids Res., 40, 2012
4AL3
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BU of 4al3 by Molmil
peptide deformylase (Co-form) with mercaptoethanol
分子名称: BETA-MERCAPTOETHANOL, CHLORIDE ION, COBALT (II) ION, ...
著者Palm, G.J, Hinrichs, W.
登録日2012-02-29
公開日2012-04-04
最終更新日2023-12-20
実験手法X-RAY DIFFRACTION (1.98 Å)
主引用文献A Fret Enzyme-Based Probe for Monitoring Hydrogen Sulfide.
Inorg.Chem., 51, 2012
4AC0
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BU of 4ac0 by Molmil
TETR(B) IN COMPLEX WITH MINOCYCLINE AND MAGNESIUM
分子名称: (4S,4AS,5AR,12AS)-4,7-BIS(DIMETHYLAMINO)-3,10,12,12A-TETRAHYDROXY-1,11-DIOXO-1,4,4A,5,5A,6,11,12A-OCTAHYDROTETRACENE-2- CARBOXAMIDE, MAGNESIUM ION, PHOSPHATE ION, ...
著者Volkers, G, Hinrichs, W.
登録日2011-12-12
公開日2012-12-26
最終更新日2023-12-20
実験手法X-RAY DIFFRACTION (2.45 Å)
主引用文献Tetr(B) in Complex with Minocycline and Magnesium
To be Published
4A99
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BU of 4a99 by Molmil
STRUCTURE OF THE TETRACYCLINE DEGRADING MONOOXYGENASE TETX IN COMPLEX WITH MINOCYCLINE
分子名称: (4S,4AS,5AR,12AS)-4,7-BIS(DIMETHYLAMINO)-3,10,12,12A-TETRAHYDROXY-1,11-DIOXO-1,4,4A,5,5A,6,11,12A-OCTAHYDROTETRACENE-2- CARBOXAMIDE, FLAVIN-ADENINE DINUCLEOTIDE, SULFATE ION, ...
著者Volkers, G, Palm, G.J, Weiss, M.S, Hinrichs, W.
登録日2011-11-25
公開日2012-12-12
最終更新日2023-12-20
実験手法X-RAY DIFFRACTION (2.18 Å)
主引用文献Putative Dioxygen-Binding Sites and Recognition of Tigecycline and Minocycline in the Tetracycline-Degrading Monooxygenase Tetx
Acta Crystallogr.,Sect.D, 69, 2013
4A5N
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BU of 4a5n by Molmil
Redoxregulator HypR in its reduced form
分子名称: 1,2-ETHANEDIOL, BETA-MERCAPTOETHANOL, UNCHARACTERIZED HTH-TYPE TRANSCRIPTIONAL REGULATOR YYBR
著者Palm, G.J, Waack, P, Read, R.J, Hinrichs, W.
登録日2011-10-26
公開日2012-01-11
最終更新日2023-12-20
実験手法X-RAY DIFFRACTION (1.81 Å)
主引用文献Structural Insights Into the Redox-Switch Mechanism of the Marr/Duf24-Type Regulator Hypr
Nucleic Acids Res., 40, 2012

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