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Structure paper

TitleStepwise O 2 -Induced Rearrangement and Disassembly of the [NiFe 4 (OH)( mu 3 -S) 4 ] Active Site Cluster of CO Dehydrogenase.
Journal, issue, pagesAngew. Chem. Int. Ed. Engl., Vol. 62, Page e202305341-e202305341, Year 2023
Publish dateMar 31, 2023 (structure data deposition date)
AuthorsBasak, Y. / Jeoung, J.H. / Domnik, L. / Dobbek, H.
External linksAngew. Chem. Int. Ed. Engl. / PubMed:37279092
MethodsX-ray diffraction
Resolution1.29 - 1.74 Å
Structure data

PDB-8omx:
NI,FE-CODH -600mV state : 1 min Dioxygen Exposure
Method: X-RAY DIFFRACTION / Resolution: 1.5 Å

PDB-8omy:
NI,FE-CODH -600mV state : 35 min Dioxygen Exposure
Method: X-RAY DIFFRACTION / Resolution: 1.37 Å

PDB-8on0:
NI,FE-CODH -600mV state : 90 min Dioxygen Exposure
Method: X-RAY DIFFRACTION / Resolution: 1.29 Å

PDB-8on1:
NI,FE-CODH -600mV state : 4 h Dioxygen Exposure
Method: X-RAY DIFFRACTION / Resolution: 1.37 Å

PDB-8on2:
NI,FE-CODH -600mV state : 24 h Dioxygen Exposure
Method: X-RAY DIFFRACTION / Resolution: 1.58 Å

PDB-8on3:
NI,FE-CODH -320mV + CN state : 24 h Dioxygen Exposure
Method: X-RAY DIFFRACTION / Resolution: 1.74 Å

Chemicals

ChemComp-SF4:
IRON/SULFUR CLUSTER

ChemComp-FES:
FE2/S2 (INORGANIC) CLUSTER

ChemComp-NFS:
FE(4)-NI(1)-S(5) CLUSTER

ChemComp-FE2:
Unknown entry

ChemComp-H2S:
HYDROSULFURIC ACID

ChemComp-HOH:
WATER

ChemComp-FE:
Unknown entry

ChemComp-VV2:
Fe-S cluster

ChemComp-PEG:
DI(HYDROXYETHYL)ETHER

Source
  • carboxydothermus hydrogenoformans z-2901 (bacteria)
KeywordsOXIDOREDUCTASE / CLUSTER C / 4FE-4S / CYTOPLASM / IRON / IRON-SULFUR / MEMBRANE / METAL-BINDING / NICKEL

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