diff --git a/mite_data/data/MITE0000215.json b/mite_data/data/MITE0000215.json new file mode 100644 index 000000000..a8bb6edac --- /dev/null +++ b/mite_data/data/MITE0000215.json @@ -0,0 +1,65 @@ +{ + "accession": "MITE0000215", + "status": "active", + "comment": "lactucin synthase", + "changelog": [ + { + "version": "1", + "date": "2025-09-18", + "contributors": [ + "0000-0001-6247-5499" + ], + "reviewers": [ + "0000-0001-6534-6609" + ], + "comment": "New entry. Reviewer changed enzyme name and description, added cofactors, and UniParc cross-reference." + } + ], + "enzyme": { + "name": "CiLCS ", + "description": "Cytochrome P450", + "references": [ + "doi:10.1021/acs.jafc.2c08959" + ], + "databaseIds": { + "uniprot": "UPI0027990047", + "genpept": "WFU92790.1" + }, + "cofactors": { + "organic": [ + "Heme" + ], + "inorganic": [ + "Fe" + ] + } + }, + "reactions": [ + { + "tailoring": [ + "Hydroxylation" + ], + "description": "Converts 8-deoxylactucin to lactucin", + "reactionSMARTS": "[#6:1]=[#6:2]1-[#6@:19]2-[#6@@:6](-[#6@@:7]3-[#6:14](=[#6:15](-[#6:17]-[#6:18]/2)-[#6:16])-[#6:12](=[#8:13])-[#6:11]=[#6:8]/3-[#6:9]-[#8:10])\\[#8:5]-[#6:3]-1=[#8:4]>>[#6:1]=[#6:2]1/[#6@:19]2-[#6@@:6](-[#6@@:7]3-[#6:14](=[#6:15](-[#6:17]-[#6@@:18]-2\\[#8])-[#6:16])-[#6:12](=[#8:13])-[#6:11]=[#6:8]/3-[#6:9]-[#8:10])\\[#8:5]-[#6:3]-1=[#8:4]", + "reactions": [ + { + "substrate": "C=C1C(=O)O[C@@H]2[C@H]3C(CO)=CC(=O)C3=C(C)CC[C@@H]12", + "products": [ + "C=C1C(=O)O[C@@H]2[C@H]3C(CO)=CC(=O)C3=C(C)C[C@H](O)[C@@H]12" + ], + "isIntermediate": true + } + ], + "evidence": { + "evidenceCode": [ + "Heterologous expression", + "In vitro assay", + "Knock-out studies" + ], + "references": [ + "doi:10.1021/acs.jafc.2c08959" + ] + } + } + ] +} \ No newline at end of file