Title : Oxygen uptake in complexes related to [NiFeS]- and [NiFeSe]-hydrogenase active sites.

Pub. Date : 2019 Feb 7

PMID : 30809352






4 Functional Relationships(s)
Download
Sentence
Compound Name
Protein Name
Organism
1 A biomimetic study for S/Se oxygenation in Ni(mu-EPh)(mu-SN2)Fe, (E = S or Se; SN2 = Me-diazacycloheptane-CH2CH2S); Fe = (eta5-C5H5)FeII(CO) complexes related to the oxygen-damaged active sites of [NiFeS]/[NiFeSe]-H2ases is described. Oxygen solute carrier family 38 member 5 Homo sapiens
2 A biomimetic study for S/Se oxygenation in Ni(mu-EPh)(mu-SN2)Fe, (E = S or Se; SN2 = Me-diazacycloheptane-CH2CH2S); Fe = (eta5-C5H5)FeII(CO) complexes related to the oxygen-damaged active sites of [NiFeS]/[NiFeSe]-H2ases is described. Oxygen solute carrier family 38 member 5 Homo sapiens
3 Computational studies (DFT) found that the lowest energy isomers of mono-oxygen derivatives of Ni(mu-EPh)(mu-SN2)Fe complexes were those with O attachment to Ni rather than Fe, a result consonant with experimental findings, but at odds with oxygenates found in oxygen-damaged [NiFeS]/[NiFeSe]-H2ase structures. Oxygen solute carrier family 38 member 5 Homo sapiens
4 Computational studies (DFT) found that the lowest energy isomers of mono-oxygen derivatives of Ni(mu-EPh)(mu-SN2)Fe complexes were those with O attachment to Ni rather than Fe, a result consonant with experimental findings, but at odds with oxygenates found in oxygen-damaged [NiFeS]/[NiFeSe]-H2ase structures. Oxygen solute carrier family 38 member 5 Homo sapiens