"Structural and Spectroscopic Properties of the Peroxodiferric Intermediate of Ricinus communis Soluble Delta(9) Desaturase"@en . . "0020-1669" . . . . "Structural and Spectroscopic Properties of the Peroxodiferric Intermediate of Ricinus communis Soluble Delta(9) Desaturase" . "000301007100014" . . "Rokob, Tibor Andr\u00E1s" . "5" . "171805" . "Solomon, E. I." . . . "P(LC512), Z(AV0Z40550506)" . "US - Spojen\u00E9 st\u00E1ty americk\u00E9" . "Structural and Spectroscopic Properties of the Peroxodiferric Intermediate of Ricinus communis Soluble Delta(9) Desaturase"@en . "Rokob, Tibor Andr\u00E1s" . . . "[FAAA208F01E3]" . . . "Structural and Spectroscopic Properties of the Peroxodiferric Intermediate of Ricinus communis Soluble Delta(9) Desaturase" . "diferrous non-heme iron enzyme; QM/MM calculations; delta-9; desaturase; reaction mechanism"@en . "51" . . "10.1021/ic2018067" . "RIV/61388963:_____/12:00377367" . "Schwartz, J. K." . . "Inorganic Chemistry" . . "6"^^ . . "15"^^ . . . "Large-scale QM/MM and QM calculations were carried out on the soluble delta-9 desaturase (D9D) to investigate various structural models of the spectroscopically defined peroxodiferric (P) intermediate. This allowed us to formulate a consistent mechanistic picture for the initial stages of the reaction mechanism of D9D, an important diferrous non-heme iron enzyme that cleaves the C-H bonds in alkane chains resulting in the highly specific insertion of double bonds."@en . . . "Srnec, Martin" . "RIV/61388963:_____/12:00377367!RIV13-AV0-61388963" . . "Rul\u00ED\u0161ek, Lubom\u00EDr" . "3"^^ . "Large-scale QM/MM and QM calculations were carried out on the soluble delta-9 desaturase (D9D) to investigate various structural models of the spectroscopically defined peroxodiferric (P) intermediate. This allowed us to formulate a consistent mechanistic picture for the initial stages of the reaction mechanism of D9D, an important diferrous non-heme iron enzyme that cleaves the C-H bonds in alkane chains resulting in the highly specific insertion of double bonds." . . "Kwak, Y." .