diff --git a/mite_data/data/36265c26-6681-11f1-8c13-d1bbc094d4fb.json b/mite_data/data/36265c26-6681-11f1-8c13-d1bbc094d4fb.json new file mode 100644 index 00000000..e1a2904c --- /dev/null +++ b/mite_data/data/36265c26-6681-11f1-8c13-d1bbc094d4fb.json @@ -0,0 +1,65 @@ +{ + "accession": "MITE9999999", + "status": "pending", + "comment": "Methylation of C-hydroxycarbazole and derivatives.", + "changelog": [ + { + "version": "1", + "date": "2026-06-12", + "contributors": [ + "0000-0002-3947-4444" + ], + "reviewers": [ + "BBBBBBBBBBBBBBBBBBBBBBBB" + ], + "comment": "Add new entry for CczI" + } + ], + "enzyme": { + "name": "CczI", + "description": "O-methyltransferase", + "references": [ + "doi:10.1021/acs.orglett.5c04621" + ], + "databaseIds": { + "uniprot": "A0A367F2Z6", + "genpept": "YAS72841.1" + }, + "cofactors": { + "organic": [ + "SAM" + ] + } + }, + "reactions": [ + { + "tailoring": [ + "Biaryl bond formation", + "Methylation", + "Reduction" + ], + "description": "Methylation of C-hydroxycarbazole", + "reactionSMARTS": "[#6:1]12:[#7:13]:[#6:8]3:[#6:9]:[#6:10]:[#6:11]:[#6:12]:[#6:7]:3:[#6:6]:1:[#6:5]:[#6:4](-[#8:14]):[#6:3]:[#6:2]:2>>[#6:1]12:[#7:13]:[#6:8]3:[#6:9]:[#6:10]:[#6:11]:[#6:12]:[#6:7]:3:[#6:6]:1:[#6:5]:[#6:4](-[#8:14]-[#6]):[#6:3]:[#6:2]:2", + "reactions": [ + { + "substrate": "Oc1ccc2[nH]c3ccccc3c2c1Cl", + "products": [ + "COc1ccc2[nH]c3ccccc3c2c1Cl" + ], + "isIntermediate": true, + "description": "O-methylation of 3-hydroxy-4-chlorocarbazole" + } + ], + "evidence": { + "evidenceCode": [ + "Heterologous expression", + "In vitro assay", + "Knock-out studies" + ], + "references": [ + "doi:10.1021/acs.orglett.5c04621" + ] + } + } + ] +} \ No newline at end of file