diff --git a/mite_data/data/be9b590e-8020-11f1-9115-dd113f401ed3.json b/mite_data/data/be9b590e-8020-11f1-9115-dd113f401ed3.json new file mode 100644 index 00000000..eb9d689d --- /dev/null +++ b/mite_data/data/be9b590e-8020-11f1-9115-dd113f401ed3.json @@ -0,0 +1,61 @@ +{ + "accession": "MITE9999999", + "status": "pending", + "comment": "Chlorination of carrier-bound phenol in the chondrochloren A pathway. Carrier protein and flavinreductase are unknown.", + "changelog": [ + { + "version": "1", + "date": "2026-07-15", + "contributors": [ + "0009-0000-8651-1669" + ], + "reviewers": [ + "BBBBBBBBBBBBBBBBBBBBBBBB" + ], + "comment": "New entry" + } + ], + "enzyme": { + "name": "CndH", + "description": "Flavin-dependent halogenase", + "references": [ + "doi:10.1016/j.jmb.2008.10.057" + ], + "databaseIds": { + "uniprot": "UPI0001932834", + "genpept": "CAQ43074.1", + "mibig": "BGC0000970" + }, + "cofactors": { + "organic": [ + "FAD" + ] + } + }, + "reactions": [ + { + "tailoring": [ + "Halogenation" + ], + "description": "Single chlorination of carrierbound chondrochloren precurser (phenol moiety)", + "reactionSMARTS": "[#6:1]1:[#6:5]:[#6:6](-[*]):[#6:4]:[#6:2]:[#6:3]:1-[#8:8]>>[#6:1]1(-[Cl]):[#6:5]:[#6:6](-[*]):[#6:4]:[#6:2]:[#6:3]:1-[#8:8]", + "reactions": [ + { + "substrate": "*c1ccc(O)cc1", + "products": [ + "*c1ccc(O)c(Cl)c1" + ], + "isIntermediate": true + } + ], + "evidence": { + "evidenceCode": [ + "Heterologous expression" + ], + "references": [ + "doi:10.1016/j.jmb.2008.10.057" + ] + } + } + ] +} \ No newline at end of file