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PDB: 104 results

3VTJ
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BU of 3vtj by Molmil
Cytochrome P450SP alpha (CYP152B1) mutant A245H
Descriptor: Fatty acid alpha-hydroxylase, PROTOPORPHYRIN IX CONTAINING FE
Authors:Fujishiro, T, Shoji, O, Sugimoto, H, Shiro, Y, Watanabe, Y.
Deposit date:2012-05-30
Release date:2013-06-05
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (2.56 Å)
Cite:A substrate-binding-state mimic of H2O2-dependent cytochrome P450 produced by one-point mutagenesis and peroxygenation of non-native substrates
Catalysis Science And Technology, 6, 2016
3WV7
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BU of 3wv7 by Molmil
HcgE from Methanothermobacter marburgensis
Descriptor: ADENOSINE-5'-DIPHOSPHATE, Hmd co-occurring protein HcgE
Authors:Fujishiro, T, Ermler, U, Shima, S.
Deposit date:2014-05-16
Release date:2015-04-29
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:Protein-pyridinol thioester precursor for biosynthesis of the organometallic acyl-iron ligand in [Fe]-hydrogenase cofactor
Nat Commun, 6, 2015
3WV8
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BU of 3wv8 by Molmil
ATP-bound HcgE from Methanothermobacter marburgensis
Descriptor: ADENOSINE-5'-TRIPHOSPHATE, Hmd co-occurring protein HcgE, SULFATE ION
Authors:Fujishiro, T, Ermler, U, Shima, S.
Deposit date:2014-05-16
Release date:2015-04-29
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Protein-pyridinol thioester precursor for biosynthesis of the organometallic acyl-iron ligand in [Fe]-hydrogenase cofactor
Nat Commun, 6, 2015
3WB2
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BU of 3wb2 by Molmil
HcgB from Methanocaldococcus jannaschii in complex with the guanylyl-pyridinol product in a model reaction of [Fe]-hydrogenase cofactor biosynthesis
Descriptor: 5'-O-[(R)-[(3,6-dimethyl-2-oxo-1,2-dihydropyridin-4-yl)oxy](hydroxy)phosphoryl]guanosine, GUANOSINE-5'-DIPHOSPHATE, MAGNESIUM ION, ...
Authors:Fujishiro, T, Ermler, U, Shima, S.
Deposit date:2013-05-11
Release date:2014-02-05
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (2.44 Å)
Cite:Identification of the HcgB enzyme in [Fe]-hydrogenase-cofactor biosynthesis.
Angew.Chem.Int.Ed.Engl., 52, 2013
3WB0
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BU of 3wb0 by Molmil
HcgB from Methanocaldococcus jannaschii in complex with light-decomposed FeGP cofactor of [Fe]-hydrogenase
Descriptor: 5'-O-[(S)-{[2-(carboxymethyl)-6-hydroxy-3,5-dimethylpyridin-4-yl]oxy}(hydroxy)phosphoryl]guanosine, Uncharacterized protein MJ0488
Authors:Fujishiro, T, Ermler, U, Shima, S.
Deposit date:2013-05-10
Release date:2014-02-05
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (1.91 Å)
Cite:Identification of the HcgB enzyme in [Fe]-hydrogenase-cofactor biosynthesis.
Angew.Chem.Int.Ed.Engl., 52, 2013
3WVB
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BU of 3wvb by Molmil
HcgF from Methanocaldococcus jannaschii
Descriptor: UPF0254 protein MJ1251
Authors:Fujishiro, T, Ermler, U, Shima, S.
Deposit date:2014-05-16
Release date:2015-04-29
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Protein-pyridinol thioester precursor for biosynthesis of the organometallic acyl-iron ligand in [Fe]-hydrogenase cofactor
Nat Commun, 6, 2015
3WVC
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BU of 3wvc by Molmil
Guanylylpyridinol (GP)-bound HcgF from Methanocaldococcus jannaschii
Descriptor: 5'-O-[(R)-hydroxy{[2-hydroxy-3,5-dimethyl-6-(2-oxo-2-sulfanylethyl)pyridin-4-yl]oxy}phosphoryl]guanosine, 5'-O-[(S)-{[2-(carboxymethyl)-6-hydroxy-3,5-dimethylpyridin-4-yl]oxy}(hydroxy)phosphoryl]guanosine, SULFATE ION, ...
Authors:Fujishiro, T, Ermler, U, Shima, S.
Deposit date:2014-05-16
Release date:2015-04-29
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (2 Å)
Cite:Protein-pyridinol thioester precursor for biosynthesis of the organometallic acyl-iron ligand in [Fe]-hydrogenase cofactor
Nat Commun, 6, 2015
3WVA
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BU of 3wva by Molmil
SeMet-labelled HcgF from Methanocaldococcus jannaschii
Descriptor: UPF0254 protein MJ1251
Authors:Fujishiro, T, Ermler, U, Shima, S.
Deposit date:2014-05-16
Release date:2015-04-29
Method:X-RAY DIFFRACTION (1.4 Å)
Cite:Protein-pyridinol thioester precursor for biosynthesis of the organometallic acyl-iron ligand in [Fe]-hydrogenase cofactor
Nat Commun, 6, 2015
7YB3
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BU of 7yb3 by Molmil
SufS with D-cysteine for 1 min
Descriptor: Cysteine desulfurase SufS, DI(HYDROXYETHYL)ETHER, TRIETHYLENE GLYCOL
Authors:Nakamura, R, Fujishiro, T.
Deposit date:2022-06-28
Release date:2023-07-05
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Snapshots of thiazolidine fomration of PLP-dependent enzyme SufS
to be published
7XEJ
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SufS with D-cysteine for 5 min
Descriptor: (2~{S})-2-[(~{E})-[2-methyl-3-oxidanyl-5-(phosphonooxymethyl)pyridin-4-yl]methylideneamino]-3-sulfanyl-propanoic acid, 1,2-ETHANEDIOL, Cysteine desulfurase SufS, ...
Authors:Nakamiura, R, Fujishiro, T.
Deposit date:2022-03-31
Release date:2023-04-05
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (1.74 Å)
Cite:X-ray crystallographic snapshots of the thioazolidine formation upon the PLP during inhibition of SufS by D-cysteine
to be published
7XEK
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BU of 7xek by Molmil
SufS with D-cysteine for 30 min
Descriptor: (2~{S},4~{S})-2-[2-methyl-3-oxidanyl-5-(phosphonooxymethyl)pyridin-4-yl]-1,3-thiazolidine-4-carboxylic acid, 1,2-ETHANEDIOL, Cysteine desulfurase SufS, ...
Authors:Nakamura, R, Fujishiro, T.
Deposit date:2022-03-31
Release date:2023-04-05
Last modified:2024-10-30
Method:X-RAY DIFFRACTION (1.88 Å)
Cite:X-ray crystallographic snapshots of the thioazolidine formation upon the PLP during inhibition of SufS by D-cysteine
to be published
7XEN
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BU of 7xen by Molmil
SufS with L-penicillamine
Descriptor: (2~{R})-3-methyl-2-[(~{E})-[2-methyl-3-oxidanyl-5-(phosphonooxymethyl)pyridin-4-yl]methylideneamino]-3-sulfanyl-butanoic acid, Cysteine desulfurase SufS
Authors:Nakamura, R, Fujishiro, T.
Deposit date:2022-03-31
Release date:2023-04-05
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.47 Å)
Cite:X-ray crystallographic snapshots of the thioazolidine formation upon the PLP during inhibition of SufS by D-cysteine
to be published
7XET
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BU of 7xet by Molmil
SufS with beta-cyano-L-alanine
Descriptor: (2~{E})-3-cyano-2-[[2-methyl-3-oxidanyl-5-(phosphonooxymethyl)pyridin-4-yl]methylimino]propanoic acid, Cysteine desulfurase SufS, DI(HYDROXYETHYL)ETHER, ...
Authors:Nakamura, R, Fujishiro, T.
Deposit date:2022-03-31
Release date:2023-04-05
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Inhibition mechanism of SufS by L-propargylglycine
to be published
7XEP
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BU of 7xep by Molmil
SufS with L-propargylglycine
Descriptor: 1,2-ETHANEDIOL, Cysteine desulfurase SufS, DI(HYDROXYETHYL)ETHER, ...
Authors:Nakamura, R, Fujishiro, T.
Deposit date:2022-03-31
Release date:2023-04-05
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (1.78 Å)
Cite:Inhibition mechanism of SufS by L-propargylglycine
to be published
7XEQ
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BU of 7xeq by Molmil
NifS with D-cysteine
Descriptor: (2~{S},4~{S})-2-[2-methyl-3-oxidanyl-5-(phosphonooxymethyl)pyridin-4-yl]-1,3-thiazolidine-4-carboxylic acid, CHLORIDE ION, Cysteine desulfurase IscS, ...
Authors:Nakamura, R, Fujishiro, T.
Deposit date:2022-03-31
Release date:2023-04-05
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.9 Å)
Cite:X-ray crystallographic snapshots of the thioazolidine formation upon the PLP during inhibition of SufS by D-cysteine
to be published
7XEL
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BU of 7xel by Molmil
SufS soaked with D-penicillamine
Descriptor: 1,2-ETHANEDIOL, Cysteine desulfurase SufS, DI(HYDROXYETHYL)ETHER, ...
Authors:Nakamura, R, Fujishiro, T.
Deposit date:2022-03-31
Release date:2023-04-05
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:X-ray crystallographic snapshots of the thioazolidine formation upon the PLP during inhibition of SufS by D-cysteine
to be published
7XES
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BU of 7xes by Molmil
NifS with L-penicillamine
Descriptor: (2~{R})-3-methyl-2-[(~{E})-[2-methyl-3-oxidanyl-5-(phosphonooxymethyl)pyridin-4-yl]methylideneamino]-3-sulfanyl-butanoic acid, CHLORIDE ION, Cysteine desulfurase IscS, ...
Authors:Nakamura, R, Fujishiro, T.
Deposit date:2022-03-31
Release date:2023-04-05
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (3 Å)
Cite:X-ray crystallographic snapshots of the thioazolidine formation upon the PLP during inhibition of SufS by D-cysteine
to be published
8I55
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BU of 8i55 by Molmil
Wild-type CfbA at 1.99 angstrom resolution
Descriptor: Sirohydrochlorin cobaltochelatase
Authors:Ogawa, S, Fujishiro, T.
Deposit date:2023-01-24
Release date:2024-01-31
Method:X-RAY DIFFRACTION (1.99 Å)
Cite:Substrate selectivity of CfbA
To be published
8I56
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BU of 8i56 by Molmil
CfbA S11T variant
Descriptor: Sirohydrochlorin cobaltochelatase
Authors:Ogawa, S, Fujishiro, T.
Deposit date:2023-01-24
Release date:2024-01-31
Method:X-RAY DIFFRACTION (2.84 Å)
Cite:Substrate selectivity of CfbA
To be published
8I58
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BU of 8i58 by Molmil
Uroporphyrin I (UPI)-bound CfbA
Descriptor: 3-[(1Z,9Z)-3,8,13,18-tetrakis(2-hydroxy-2-oxoethyl)-7,12,17-tris(3-hydroxy-3-oxopropyl)-21,23-dihydroporphyrin-2-yl]propanoic acid, Sirohydrochlorin cobaltochelatase
Authors:Ogawa, S, Fujishiro, T.
Deposit date:2023-01-24
Release date:2024-01-31
Method:X-RAY DIFFRACTION (3.09 Å)
Cite:Substrate selectivity of CfbA
To be published
8I57
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BU of 8i57 by Molmil
Uroporphyrin III (UPIII)-bound CfbA
Descriptor: 3,3',3'',3'''-[3,8,13,17-tetrakis(carboxymethyl)porphyrin-2,7,12,18-tetrayl]tetrapropanoic acid, Sirohydrochlorin cobaltochelatase
Authors:Ogawa, S, Fujishiro, T.
Deposit date:2023-01-24
Release date:2024-01-31
Method:X-RAY DIFFRACTION (2.81 Å)
Cite:Substrate selectivity of CfbA
To be published
8IYU
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BU of 8iyu by Molmil
CfbA S11T variant with Ni(II) ions
Descriptor: NICKEL (II) ION, Sirohydrochlorin cobaltochelatase
Authors:Ogawa, S, Fujishiro, T.
Deposit date:2023-04-06
Release date:2024-04-10
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Substrate selectivity of CfbA
To be published
2ZQX
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BU of 2zqx by Molmil
Cytochrome P450BSbeta cocrystallized with heptanoic acid
Descriptor: Cytochrome P450 152A1, PROTOPORPHYRIN IX CONTAINING FE
Authors:Shoji, O, Fujishiro, T, Nagano, S, Hirose, T, Shiro, Y, Watanabe, Y.
Deposit date:2008-08-22
Release date:2009-08-25
Last modified:2023-11-01
Method:X-RAY DIFFRACTION (2.37 Å)
Cite:Understanding substrate misrecognition of hydrogen peroxide dependent cytochrome P450 from Bacillus subtilis.
J.Biol.Inorg.Chem., 2010
2ZQJ
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BU of 2zqj by Molmil
Substrate-Free Form of Cytochrome P450BSbeta
Descriptor: Cytochrome P450 152A1, PROTOPORPHYRIN IX CONTAINING FE
Authors:Shoji, O, Fujishiro, T, Nagano, S, Hirose, T, Shiro, Y, Watanabe, Y.
Deposit date:2008-08-11
Release date:2009-09-01
Last modified:2023-11-01
Method:X-RAY DIFFRACTION (2.9 Å)
Cite:Understanding substrate misrecognition of hydrogen peroxide dependent cytochrome P450 from Bacillus subtilis.
J.Biol.Inorg.Chem., 2010
6KG1
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BU of 6kg1 by Molmil
NifS from Helicobacter pylori, soaked with L-cysteine for 180 sec
Descriptor: 2-[(3-HYDROXY-2-METHYL-5-PHOSPHONOOXYMETHYL-PYRIDIN-4-YLMETHYL)-AMINO]-PROPIONIC ACID, CHLORIDE ION, Cysteine desulfurase IscS, ...
Authors:Nakamura, R, Takahashi, Y, Fujishiro, T.
Deposit date:2019-07-09
Release date:2019-10-16
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (2.7 Å)
Cite:Snapshots of PLP-substrate and PLP-product external aldimines as intermediates in two types of cysteine desulfurase enzymes.
Febs J., 287, 2020

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