6ELQ
| Carbon Monoxide Dehydrogenase IV from Carboxydothermus hydrogenoformans | Descriptor: | Carbon Monoxide Dehydrogenase, FE(4)-NI(1)-S(5) CLUSTER with Oxygen, IRON/SULFUR CLUSTER | Authors: | Domnik, L, Goetzl, S, Jeoung, J.H, Dobbek, H. | Deposit date: | 2017-09-29 | Release date: | 2018-01-03 | Last modified: | 2024-05-08 | Method: | X-RAY DIFFRACTION (2.52 Å) | Cite: | CODH-IV: A High-Efficiency CO-Scavenging CO Dehydrogenase with Resistance to O2. Angew. Chem. Int. Ed. Engl., 56, 2017
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5FLE
| High resolution NI,FE-CODH-320 mV with CN state | Descriptor: | CARBON MONOXIDE DEHYDROGENASE 2, FE (II) ION, FE2/S2 (INORGANIC) CLUSTER, ... | Authors: | Ciaccafava, A, Tombolelli, D, Domnik, L, Fesseler, J, Jeoung, J.-H, Dobbek, H, Mroginski, M.A, Hildebrandt, P, Zebger, I. | Deposit date: | 2015-10-26 | Release date: | 2016-09-14 | Last modified: | 2024-01-10 | Method: | X-RAY DIFFRACTION (1.23 Å) | Cite: | When the inhibitor tells more than the substrate: the cyanide-bound state of a carbon monoxide dehydrogenase. Chem Sci, 7, 2016
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7ZKJ
| CODH/ACS complex of C. hydrogenoformans | Descriptor: | (4R)-2-METHYLPENTANE-2,4-DIOL, (4S)-2-METHYL-2,4-PENTANEDIOL, ACETATE ION, ... | Authors: | Ruickoldt, J, Jeoung, J.-H, Basak, Y, Domnik, L, Dobbek, H. | Deposit date: | 2022-04-13 | Release date: | 2022-11-02 | Last modified: | 2024-01-31 | Method: | X-RAY DIFFRACTION (2.04 Å) | Cite: | On the Kinetics of CO2 Reduction by Ni, Fe-CO Dehydrogenases ACS Catal., 2022
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7ZKK
| A216H variant of the CODH/ACS complex of C. hydrogenoformans | Descriptor: | (4S)-2-METHYL-2,4-PENTANEDIOL, ACETATE ION, CO-methylating acetyl-CoA synthase, ... | Authors: | Ruickoldt, J, Jeoung, J.-H, Basak, Y, Domnik, L, Dobbek, H. | Deposit date: | 2022-04-13 | Release date: | 2022-11-02 | Last modified: | 2024-01-31 | Method: | X-RAY DIFFRACTION (1.97 Å) | Cite: | On the Kinetics of CO2 Reduction by Ni, Fe-CO Dehydrogenases Acs Catalysis, 2022
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7ZKV
| F231A variant of the CODH/ACS complex of C. hydrogenoformans | Descriptor: | (4R)-2-METHYLPENTANE-2,4-DIOL, ACETATE ION, CO-methylating acetyl-CoA synthase, ... | Authors: | Ruickoldt, J, Jeoung, J.-H, Basak, Y, Domnik, L, Dobbek, H. | Deposit date: | 2022-04-13 | Release date: | 2022-11-02 | Last modified: | 2024-06-19 | Method: | X-RAY DIFFRACTION (2.066 Å) | Cite: | Coupling CO2 Reduction and Acetyl-CoA Formation: The Role of a CO Capturing Tunnel in Enzymatic Catalysis. Angew.Chem.Int.Ed.Engl., 2024
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8OMY
| NI,FE-CODH -600mV state : 35 min Dioxygen Exposure | Descriptor: | Carbon monoxide dehydrogenase 2, FE (II) ION, FE (III) ION, ... | Authors: | Basak, Y, Jeoung, J.-H, Dobbek, H. | Deposit date: | 2023-03-31 | Release date: | 2023-12-06 | Method: | X-RAY DIFFRACTION (1.37 Å) | Cite: | Stepwise O 2 -Induced Rearrangement and Disassembly of the [NiFe 4 (OH)( mu 3 -S) 4 ] Active Site Cluster of CO Dehydrogenase. Angew.Chem.Int.Ed.Engl., 62, 2023
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8ON2
| NI,FE-CODH -600mV state : 24 h Dioxygen Exposure | Descriptor: | Carbon monoxide dehydrogenase 2, FE (III) ION, FE2/S2 (INORGANIC) CLUSTER, ... | Authors: | Basak, Y, Jeoung, J.-H, Dobbek, H. | Deposit date: | 2023-03-31 | Release date: | 2023-12-06 | Method: | X-RAY DIFFRACTION (1.58 Å) | Cite: | Stepwise O 2 -Induced Rearrangement and Disassembly of the [NiFe 4 (OH)( mu 3 -S) 4 ] Active Site Cluster of CO Dehydrogenase. Angew.Chem.Int.Ed.Engl., 62, 2023
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8OMX
| NI,FE-CODH -600mV state : 1 min Dioxygen Exposure | Descriptor: | Carbon monoxide dehydrogenase 2, FE (II) ION, FE(4)-NI(1)-S(5) CLUSTER, ... | Authors: | Basak, Y, Jeoung, J.-H, Dobbek, H. | Deposit date: | 2023-03-31 | Release date: | 2023-12-06 | Method: | X-RAY DIFFRACTION (1.5 Å) | Cite: | Stepwise O 2 -Induced Rearrangement and Disassembly of the [NiFe 4 (OH)( mu 3 -S) 4 ] Active Site Cluster of CO Dehydrogenase. Angew.Chem.Int.Ed.Engl., 62, 2023
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8ON0
| NI,FE-CODH -600mV state : 90 min Dioxygen Exposure | Descriptor: | Carbon monoxide dehydrogenase 2, FE (II) ION, FE (III) ION, ... | Authors: | Basak, Y, Jeoung, J.-H, Dobbek, H. | Deposit date: | 2023-03-31 | Release date: | 2023-12-06 | Method: | X-RAY DIFFRACTION (1.29 Å) | Cite: | Stepwise O 2 -Induced Rearrangement and Disassembly of the [NiFe 4 (OH)( mu 3 -S) 4 ] Active Site Cluster of CO Dehydrogenase. Angew.Chem.Int.Ed.Engl., 62, 2023
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8ON1
| NI,FE-CODH -600mV state : 4 h Dioxygen Exposure | Descriptor: | Carbon monoxide dehydrogenase 2, FE (II) ION, FE (III) ION, ... | Authors: | Basak, Y, Jeoung, J.-H, Dobbek, H. | Deposit date: | 2023-03-31 | Release date: | 2023-12-06 | Method: | X-RAY DIFFRACTION (1.37 Å) | Cite: | Stepwise O 2 -Induced Rearrangement and Disassembly of the [NiFe 4 (OH)( mu 3 -S) 4 ] Active Site Cluster of CO Dehydrogenase. Angew.Chem.Int.Ed.Engl., 62, 2023
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8ON3
| NI,FE-CODH -320mV + CN state : 24 h Dioxygen Exposure | Descriptor: | Carbon monoxide dehydrogenase 2, DI(HYDROXYETHYL)ETHER, FE (II) ION, ... | Authors: | Basak, Y, Jeoung, J.-H, Dobbek, H. | Deposit date: | 2023-03-31 | Release date: | 2023-12-06 | Method: | X-RAY DIFFRACTION (1.74 Å) | Cite: | Stepwise O 2 -Induced Rearrangement and Disassembly of the [NiFe 4 (OH)( mu 3 -S) 4 ] Active Site Cluster of CO Dehydrogenase. Angew.Chem.Int.Ed.Engl., 62, 2023
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7B95
| CooS-V with partially oxidized hybrid cluster by hydroxylamine | Descriptor: | (R,R)-2,3-BUTANEDIOL, Carbon monoxide dehydrogenase, DI(HYDROXYETHYL)ETHER, ... | Authors: | Jeoung, J.H, Dobbek, H. | Deposit date: | 2020-12-14 | Release date: | 2022-01-12 | Last modified: | 2024-01-31 | Method: | X-RAY DIFFRACTION (1.4 Å) | Cite: | A Morphing [4Fe-3S-nO]-Cluster within a Carbon Monoxide Dehydrogenase Scaffold. Angew.Chem.Int.Ed.Engl., 61, 2022
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7B9A
| CooS-V with Xe-soaked | Descriptor: | 3,5-dioxa-7-thia-1-thionia-2$l^{2},4$l^{2},6$l^{3},8$l^{2}-tetraferrabicyclo[4.2.0]octane, BROMIDE ION, Carbon monoxide dehydrogenase, ... | Authors: | Jeoung, J.H, Dobbek, H. | Deposit date: | 2020-12-14 | Release date: | 2022-01-12 | Last modified: | 2024-01-31 | Method: | X-RAY DIFFRACTION (2.5 Å) | Cite: | A Morphing [4Fe-3S-nO]-Cluster within a Carbon Monoxide Dehydrogenase Scaffold. Angew.Chem.Int.Ed.Engl., 61, 2022
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7B97
| CooS-V with oxidized hybrid cluster by hydroxylamine for 30 min | Descriptor: | (R,R)-2,3-BUTANEDIOL, 3,5-dioxa-7-thia-1-thionia-2$l^{2},4$l^{2},6$l^{3},8$l^{2}-tetraferrabicyclo[4.2.0]octane, Carbon monoxide dehydrogenase, ... | Authors: | Jeoung, J.H, Dobbek, H. | Deposit date: | 2020-12-14 | Release date: | 2022-01-12 | Last modified: | 2024-01-31 | Method: | X-RAY DIFFRACTION (1.45 Å) | Cite: | A Morphing [4Fe-3S-nO]-Cluster within a Carbon Monoxide Dehydrogenase Scaffold. Angew.Chem.Int.Ed.Engl., 61, 2022
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7B7T
| CooS-V with oxidized hybrid cluster | Descriptor: | (R,R)-2,3-BUTANEDIOL, Carbon monoxide dehydrogenase, DI(HYDROXYETHYL)ETHER, ... | Authors: | Jeoung, J.H, Dobbek, H. | Deposit date: | 2020-12-11 | Release date: | 2022-01-12 | Last modified: | 2024-01-31 | Method: | X-RAY DIFFRACTION (1.38 Å) | Cite: | A Morphing [4Fe-3S-nO]-Cluster within a Carbon Monoxide Dehydrogenase Scaffold. Angew.Chem.Int.Ed.Engl., 61, 2022
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7B7Q
| CooS-V with oxidized hybrid cluster | Descriptor: | 3,5-dioxa-7-thia-1-thionia-2$l^{2},4$l^{2},6$l^{3},8$l^{2}-tetraferrabicyclo[4.2.0]octane, Carbon monoxide dehydrogenase, DI(HYDROXYETHYL)ETHER, ... | Authors: | Jeoung, J.H, Dobbek, H. | Deposit date: | 2020-12-11 | Release date: | 2022-01-12 | Last modified: | 2024-01-31 | Method: | X-RAY DIFFRACTION (1.35 Å) | Cite: | A Morphing [4Fe-3S-nO]-Cluster within a Carbon Monoxide Dehydrogenase Scaffold. Angew.Chem.Int.Ed.Engl., 61, 2022
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7ZX6
| I567L Mutant of Recombinant CODH-II | Descriptor: | Carbon monoxide dehydrogenase 2, FE (II) ION, FE(3)-NI(1)-S(4) CLUSTER, ... | Authors: | Basak, Y, Jeoung, J.-H, Dobbek, H. | Deposit date: | 2022-05-20 | Release date: | 2023-03-15 | Last modified: | 2024-02-07 | Method: | X-RAY DIFFRACTION (1.447 Å) | Cite: | Substrate Activation at the Ni,Fe Cluster of CO Dehydrogenases: The Influence of the Protein Matrix Acs Catalysis, 2022
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7ZX3
| C295D Mutant of Recombinant CODH-II | Descriptor: | Carbon monoxide dehydrogenase 2, DI(HYDROXYETHYL)ETHER, FE2/S2 (INORGANIC) CLUSTER, ... | Authors: | Basak, Y, Jeoung, J.H, Dobbek, H. | Deposit date: | 2022-05-20 | Release date: | 2023-03-15 | Last modified: | 2024-02-07 | Method: | X-RAY DIFFRACTION (1.683 Å) | Cite: | Substrate Activation at the Ni,Fe Cluster of CO Dehydrogenases: The Influence of the Protein Matrix Acs Catalysis, 2022
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7ZXJ
| K563A Mutant of Recombinant CODH-II | Descriptor: | Carbon monoxide dehydrogenase 2, DI(HYDROXYETHYL)ETHER, FE (II) ION, ... | Authors: | Basak, Y, Jeoung, J.H, Dobbek, H. | Deposit date: | 2022-05-21 | Release date: | 2023-03-15 | Last modified: | 2024-02-07 | Method: | X-RAY DIFFRACTION (1.249 Å) | Cite: | Substrate Activation at the Ni,Fe Cluster of CO Dehydrogenases: The Influence of the Protein Matrix Acs Catalysis, 2022
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7ZXX
| K563H Mutant of Recombinant CODH-II | Descriptor: | Carbon monoxide dehydrogenase 2, DI(HYDROXYETHYL)ETHER, FE2/S2 (INORGANIC) CLUSTER, ... | Authors: | Basak, Y, Jeoung, J.H, Dobbek, H. | Deposit date: | 2022-05-23 | Release date: | 2023-03-15 | Last modified: | 2024-02-07 | Method: | X-RAY DIFFRACTION (1.4 Å) | Cite: | Substrate Activation at the Ni,Fe Cluster of CO Dehydrogenases: The Influence of the Protein Matrix Acs Catalysis, 2022
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7ZY1
| I567A Mutant of Recombinant CODH-II | Descriptor: | Carbon monoxide dehydrogenase 2, FE (II) ION, FE(3)-NI(1)-S(4) CLUSTER, ... | Authors: | Basak, Y, Jeoung, J.H, Dobbek, H. | Deposit date: | 2022-05-23 | Release date: | 2023-03-15 | Last modified: | 2024-02-07 | Method: | X-RAY DIFFRACTION (1.434 Å) | Cite: | Substrate Activation at the Ni,Fe Cluster of CO Dehydrogenases: The Influence of the Protein Matrix Acs Catalysis, 2022
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7ZXC
| H96D Mutant of Recombinant CODH-II | Descriptor: | Carbon monoxide dehydrogenase 2, FE (III) ION, FE(3)-NI(1)-S(4) CLUSTER, ... | Authors: | Basak, Y, Jeoung, J.H, Dobbek, H. | Deposit date: | 2022-05-20 | Release date: | 2023-03-15 | Last modified: | 2024-02-07 | Method: | X-RAY DIFFRACTION (1.696 Å) | Cite: | Substrate Activation at the Ni,Fe Cluster of CO Dehydrogenases: The Influence of the Protein Matrix Acs Catalysis, 2022
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7ZX5
| I567T Mutant of Recombinant CODH-II | Descriptor: | Carbon monoxide dehydrogenase 2, FE (II) ION, FE(3)-NI(1)-S(4) CLUSTER, ... | Authors: | Basak, Y, Jeoung, J.H, Dobbek, H. | Deposit date: | 2022-05-20 | Release date: | 2023-03-15 | Last modified: | 2024-02-07 | Method: | X-RAY DIFFRACTION (1.544 Å) | Cite: | Substrate Activation at the Ni,Fe Cluster of CO Dehydrogenases: The Influence of the Protein Matrix Acs Catalysis, 2022
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7ZXL
| H93A Mutant of Recombinant CODH-II | Descriptor: | Carbon monoxide dehydrogenase 2, FE (II) ION, FE(3)-NI(1)-S(4) CLUSTER, ... | Authors: | Basak, Y, Jeoung, J.-H, Dobbek, H. | Deposit date: | 2022-05-21 | Release date: | 2023-03-15 | Last modified: | 2024-02-07 | Method: | X-RAY DIFFRACTION (1.2 Å) | Cite: | Substrate Activation at the Ni,Fe Cluster of CO Dehydrogenases: The Influence of the Protein Matrix Acs Catalysis, 2022
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