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8A9E
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BU of 8a9e by Molmil
Lysozyme, 9-11 fs FEL pulses as determined by XTCAV
Descriptor: 10-((2R)-2-HYDROXYPROPYL)-1,4,7,10-TETRAAZACYCLODODECANE 1,4,7-TRIACETIC ACID, GADOLINIUM ATOM, Lysozyme
Authors:Barends, T, Nass, K, Gorel, A, Schlichting, I.
Deposit date:2022-06-28
Release date:2023-07-12
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (1.665 Å)
Cite:Microcrystallization methods
To Be Published
8A9F
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BU of 8a9f by Molmil
Thaumatin, 9-11 fs FEL pulses as determined by XTCAV
Descriptor: L(+)-TARTARIC ACID, Thaumatin-1
Authors:Barends, T, Nass, K, Gorel, A, Schlichting, I.
Deposit date:2022-06-28
Release date:2023-07-12
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (1.88 Å)
Cite:Microcrystallization paper
To Be Published
6FKW
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BU of 6fkw by Molmil
Europium-containing methanol dehydrogenase
Descriptor: EUROPIUM ION, Methanol dehydrogenase, PYRROLOQUINOLINE QUINONE
Authors:Barends, T, Dietl, A.
Deposit date:2018-01-24
Release date:2018-03-21
Last modified:2024-01-17
Method:X-RAY DIFFRACTION (1.4 Å)
Cite:Similar but not the same: First Kinetic and Structural Analyses of a Methanol Dehydrogenase Containing a Europium Ion in the Active Site.
Chembiochem, 2018
5MXZ
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BU of 5mxz by Molmil
Kustc0563 Y40F mutant
Descriptor: 1,2-ETHANEDIOL, ACETATE ION, Cytochrome c-552 Ks_3358, ...
Authors:Mohd, A, Barends, T.
Deposit date:2017-01-25
Release date:2018-02-14
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Structure and Function of the c-type cytochrome Kustc0563 from Kuenenia stuttgartiensis
To Be Published
7ZS2
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BU of 7zs2 by Molmil
Diheme cytochrome c Kustd1711 from Kuenenia stuttgartiensis, M292H mutant
Descriptor: CALCIUM ION, HEME C, Hypothetical (Diheme) protein
Authors:Akram, M, Barends, T.
Deposit date:2022-05-05
Release date:2023-05-17
Method:X-RAY DIFFRACTION (1.12 Å)
Cite:Redox potential tuning by calcium ions in a novel c-type cytochrome from an anammox organism
To Be Published
7ZS1
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BU of 7zs1 by Molmil
Diheme cytochrome c Kustd1711 from Kuenenia stuttgartiensis, M292C mutant
Descriptor: CALCIUM ION, GLYCEROL, HEME C, ...
Authors:Akram, M, Barends, T.
Deposit date:2022-05-05
Release date:2023-05-17
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Redox potential tuning by calcium ions in a novel c-type cytochrome from an anammox organism
To Be Published
7ZS0
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BU of 7zs0 by Molmil
Diheme cytochrome c Kustd1711 from Kuenenia stuttgartiensis
Descriptor: CALCIUM ION, GLYCEROL, HEME C, ...
Authors:Akram, M, Barends, T.
Deposit date:2022-05-05
Release date:2023-05-17
Method:X-RAY DIFFRACTION (1.75 Å)
Cite:Redox potential tuning by calcium ions in a novel c-type cytochrome from an anammox organism
To Be Published
2RHG
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BU of 2rhg by Molmil
Tryptophan synthase complexed with IGP, pH 7.0, internal aldimine
Descriptor: INDOLE-3-GLYCEROL PHOSPHATE, PYRIDOXAL-5'-PHOSPHATE, SODIUM ION, ...
Authors:Kulik, V, Barends, T, Schlichting, I.
Deposit date:2007-10-09
Release date:2007-11-20
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2 Å)
Cite:Tryptophan synthase complexed with IGP, pH 7.0, internal aldimine
To be Published
7QV0
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BU of 7qv0 by Molmil
Covalent complex between Scalindua brodae amxFabZ and amxACP
Descriptor: Acyl carrier protein, Beta-hydroxyacyl-(Acyl-carrier-protein) dehydratase, S-[2-[3-[[(2R)-3,3-dimethyl-2-oxidanyl-4-phosphonooxy-butanoyl]amino]propanoylamino]ethyl] (Z)-hex-2-enethioate
Authors:Barends, T, Dietl, A.
Deposit date:2022-01-19
Release date:2023-02-01
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (2.49 Å)
Cite:Structures of an unusual 3-hydroxyacyl dehydratase (FabZ) from a ladderane-producing organism with an unexpected substrate preference.
J.Biol.Chem., 299, 2023
3GFX
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BU of 3gfx by Molmil
Klebsiella pneumoniae BlrP1 pH 4.5 calcium/cy-diGMP complex
Descriptor: 9,9'-[(2R,3R,3aS,5S,7aR,9R,10R,10aS,12S,14aR)-3,5,10,12-tetrahydroxy-5,12-dioxidooctahydro-2H,7H-difuro[3,2-d:3',2'-j][1,3,7,9,2,8]tetraoxadiphosphacyclododecine-2,9-diyl]bis(2-amino-1,9-dihydro-6H-purin-6-one), CALCIUM ION, FLAVIN MONONUCLEOTIDE, ...
Authors:Barends, T, Hartmann, E, Griese, J, Beitlich, T, Kirienko, N, Ryjenkov, D, Reinstein, J, Shoeman, R, Gomelsky, M, Schlichting, I.
Deposit date:2009-02-27
Release date:2009-06-23
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Structure and mechanism of a bacterial light-regulated cyclic nucleotide phosphodiesterase.
Nature, 459, 2009
3GG1
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BU of 3gg1 by Molmil
Klebsiella pneumoniae BlrP1 pH 8.0 calcium/cy-diGMP complex
Descriptor: 9,9'-[(2R,3R,3aS,5S,7aR,9R,10R,10aS,12S,14aR)-3,5,10,12-tetrahydroxy-5,12-dioxidooctahydro-2H,7H-difuro[3,2-d:3',2'-j][1,3,7,9,2,8]tetraoxadiphosphacyclododecine-2,9-diyl]bis(2-amino-1,9-dihydro-6H-purin-6-one), CALCIUM ION, FLAVIN MONONUCLEOTIDE, ...
Authors:Barends, T, Hartmann, E, Griese, J, Beitlich, T, Kirienko, N, Ryjenkov, D, Reinstein, J, Shoeman, R, Gomelsky, M, Schlichting, I.
Deposit date:2009-02-27
Release date:2009-06-23
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Structure and mechanism of a bacterial light-regulated cyclic nucleotide phosphodiesterase.
Nature, 459, 2009
3GFZ
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BU of 3gfz by Molmil
Klebsiella pneumoniae BlrP1 pH 6 manganese/cy-diGMP complex
Descriptor: 9,9'-[(2R,3R,3aS,5S,7aR,9R,10R,10aS,12S,14aR)-3,5,10,12-tetrahydroxy-5,12-dioxidooctahydro-2H,7H-difuro[3,2-d:3',2'-j][1,3,7,9,2,8]tetraoxadiphosphacyclododecine-2,9-diyl]bis(2-amino-1,9-dihydro-6H-purin-6-one), FLAVIN MONONUCLEOTIDE, Klebsiella pneumoniae BlrP1, ...
Authors:Barends, T, Hartmann, E, Griese, J, Beitlich, T, Kirienko, N, Ryjenkov, D, Reinstein, J, Shoeman, R, Gomelsky, M, Schlichting, I.
Deposit date:2009-02-27
Release date:2009-06-23
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (2.05 Å)
Cite:Structure and mechanism of a bacterial light-regulated cyclic nucleotide phosphodiesterase.
Nature, 459, 2009
3GG0
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BU of 3gg0 by Molmil
Klebsiella pneumoniae BlrP1 pH 9.0 manganese/cy-diGMP complex
Descriptor: 9,9'-[(2R,3R,3aS,5S,7aR,9R,10R,10aS,12S,14aR)-3,5,10,12-tetrahydroxy-5,12-dioxidooctahydro-2H,7H-difuro[3,2-d:3',2'-j][1,3,7,9,2,8]tetraoxadiphosphacyclododecine-2,9-diyl]bis(2-amino-1,9-dihydro-6H-purin-6-one), FLAVIN MONONUCLEOTIDE, Klebsiella pneumoniae BlrP1, ...
Authors:Barends, T, Hartmann, E, Griese, J, Beitlich, T, Kirienko, N, Ryjenkov, D, Reinstein, J, Shoeman, R, Gomelsky, M, Schlichting, I.
Deposit date:2009-02-27
Release date:2009-06-23
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (2.55 Å)
Cite:Structure and mechanism of a bacterial light-regulated cyclic nucleotide phosphodiesterase.
Nature, 459, 2009
3GFY
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BU of 3gfy by Molmil
Klebsiella pneumoniae BlrP1 with FMN and cyclic diGMP, no metal ions
Descriptor: 9,9'-[(2R,3R,3aS,5S,7aR,9R,10R,10aS,12S,14aR)-3,5,10,12-tetrahydroxy-5,12-dioxidooctahydro-2H,7H-difuro[3,2-d:3',2'-j][1,3,7,9,2,8]tetraoxadiphosphacyclododecine-2,9-diyl]bis(2-amino-1,9-dihydro-6H-purin-6-one), FLAVIN MONONUCLEOTIDE, Klebsiella pneumoniae BlrP1
Authors:Barends, T, Hartmann, E, Griese, J, Beitlich, T, Kirienko, N, Ryjenkov, D, Reinstein, J, Shoeman, R, Gomelsky, M, Schlichting, I.
Deposit date:2009-02-27
Release date:2009-06-23
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:Structure and mechanism of a bacterial light-regulated cyclic nucleotide phosphodiesterase.
Nature, 459, 2009
8BKH
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BU of 8bkh by Molmil
Carboxymyoglobin dark state for comparison with power titration and 23 / 101 mJ/cm2 time series
Descriptor: CARBON MONOXIDE, Myoglobin, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:Barends, T, Schlichting, I.
Deposit date:2022-11-09
Release date:2024-01-31
Last modified:2024-03-06
Method:X-RAY DIFFRACTION (1.35 Å)
Cite:Influence of pump laser fluence on ultrafast myoglobin structural dynamics.
Nature, 626, 2024
8BKN
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BU of 8bkn by Molmil
Carboxymyoglobin dark state for comparison with 5 mJ/cm2 time series
Descriptor: CARBON MONOXIDE, Myoglobin, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:Barends, T, Schlichting, I.
Deposit date:2022-11-09
Release date:2024-01-31
Last modified:2024-03-06
Method:X-RAY DIFFRACTION (1.29 Å)
Cite:Influence of pump laser fluence on ultrafast myoglobin structural dynamics.
Nature, 626, 2024
8R8I
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BU of 8r8i by Molmil
Ensemble-refined carboxymyoglobin photolysis power titration, 56 mJ/cm2
Descriptor: CARBON MONOXIDE, Myoglobin, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:Barends, T, Schlichting, I.
Deposit date:2023-11-29
Release date:2024-01-31
Last modified:2024-03-06
Method:X-RAY DIFFRACTION (1.4 Å)
Cite:Influence of pump laser fluence on ultrafast myoglobin structural dynamics.
Nature, 626, 2024
8R8H
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BU of 8r8h by Molmil
Ensemble-refined carboxymyoglobin photolysis power titration, 31 mJ/cm2
Descriptor: CARBON MONOXIDE, Myoglobin, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:Barends, T, Schlichting, I.
Deposit date:2023-11-29
Release date:2024-01-31
Last modified:2024-03-06
Method:X-RAY DIFFRACTION (1.4 Å)
Cite:Influence of pump laser fluence on ultrafast myoglobin structural dynamics.
Nature, 626, 2024
8R9D
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BU of 8r9d by Molmil
Multicopy-refined carboxymyoglobin photolysis time series at 23 mJ/cm2 laser fluence, 399 fs time delay
Descriptor: CARBON MONOXIDE, Myoglobin, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:Barends, T, Schlichting, I.
Deposit date:2023-11-30
Release date:2024-01-31
Last modified:2024-03-06
Method:X-RAY DIFFRACTION (1.4 Å)
Cite:Influence of pump laser fluence on ultrafast myoglobin structural dynamics.
Nature, 626, 2024
8R93
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BU of 8r93 by Molmil
Multicopy-refined carboxymyoglobin photolysis time series at 5 mJ/cm2 laser fluence, 847 fs time delay
Descriptor: CARBON MONOXIDE, Myoglobin, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:Barends, T, Schlichting, I.
Deposit date:2023-11-30
Release date:2024-01-31
Last modified:2024-03-06
Method:X-RAY DIFFRACTION (1.4 Å)
Cite:Influence of pump laser fluence on ultrafast myoglobin structural dynamics.
Nature, 626, 2024
8R9P
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BU of 8r9p by Molmil
Multicopy-refined carboxymyoglobin photolysis time series at 23 mJ/cm2 laser fluence, 1297 fs time delay
Descriptor: CARBON MONOXIDE, Myoglobin, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:Barends, T, Schlichting, I.
Deposit date:2023-11-30
Release date:2024-01-31
Last modified:2024-03-06
Method:X-RAY DIFFRACTION (1.4 Å)
Cite:Influence of pump laser fluence on ultrafast myoglobin structural dynamics.
Nature, 626, 2024
8RAB
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BU of 8rab by Molmil
Multicopy-refined carboxymyoglobin photolysis time series at 101 mJ/cm2 laser fluence, 1112 fs time delay
Descriptor: CARBON MONOXIDE, Myoglobin, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:Barends, T, Schlichting, I.
Deposit date:2023-12-01
Release date:2024-01-31
Last modified:2024-03-06
Method:X-RAY DIFFRACTION (1.4 Å)
Cite:Influence of pump laser fluence on ultrafast myoglobin structural dynamics.
Nature, 626, 2024
8R9L
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BU of 8r9l by Molmil
Multicopy-refined carboxymyoglobin photolysis time series at 23 mJ/cm2 laser fluence, 1036 fs time delay
Descriptor: CARBON MONOXIDE, Myoglobin, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:Barends, T, Schlichting, I.
Deposit date:2023-11-30
Release date:2024-01-31
Last modified:2024-03-06
Method:X-RAY DIFFRACTION (1.4 Å)
Cite:Influence of pump laser fluence on ultrafast myoglobin structural dynamics.
Nature, 626, 2024
8RA7
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BU of 8ra7 by Molmil
Multicopy-refined carboxymyoglobin photolysis time series at 101 mJ/cm2 laser fluence, 722 fs time delay
Descriptor: CARBON MONOXIDE, Myoglobin, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:Barends, T, Schlichting, I.
Deposit date:2023-12-01
Release date:2024-01-31
Last modified:2024-03-06
Method:X-RAY DIFFRACTION (1.4 Å)
Cite:Influence of pump laser fluence on ultrafast myoglobin structural dynamics.
Nature, 626, 2024
8R8G
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BU of 8r8g by Molmil
Ensemble-refined carboxymyoglobin photolysis power titration, 18 mJ/cm2
Descriptor: CARBON MONOXIDE, Myoglobin, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:Barends, T, Schlichting, I.
Deposit date:2023-11-29
Release date:2024-01-31
Last modified:2024-03-06
Method:X-RAY DIFFRACTION (1.4 Å)
Cite:Influence of pump laser fluence on ultrafast myoglobin structural dynamics.
Nature, 626, 2024

 

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