diff --git a/mite_data/data/ac03b692-a6a9-11f1-b4b1-cf84655b59e7.json b/mite_data/data/ac03b692-a6a9-11f1-b4b1-cf84655b59e7.json new file mode 100644 index 00000000..a59123a6 --- /dev/null +++ b/mite_data/data/ac03b692-a6a9-11f1-b4b1-cf84655b59e7.json @@ -0,0 +1,62 @@ +{ + "accession": "MITE9999999", + "status": "pending", + "comment": "NgvF is a homologue of AoiQ-Methyltransferase domain and can perform methylation to produce dichlorodiaporthin", + "changelog": [ + { + "version": "1", + "date": "2026-09-02", + "contributors": [ + "0009-0008-8086-5325" + ], + "reviewers": [ + "BBBBBBBBBBBBBBBBBBBBBBBB" + ], + "comment": "New entry." + } + ], + "enzyme": { + "name": "NgvF", + "description": "O-methyltransferase", + "references": [ + "doi:10.1021/jacs.1c02868" + ], + "databaseIds": { + "uniprot": "UPI0009D33686", + "genpept": "OQE91620.1" + }, + "cofactors": { + "organic": [ + "SAM" + ] + } + }, + "reactions": [ + { + "tailoring": [ + "Methylation" + ], + "description": "NgvF, a homologue of AoiQ-MT domain catalyzes methylation to form a O-6-methylated structure, dichlorodiaporthin", + "reactionSMARTS": "[#8:1]-[#6:2]1:[#6:19]:[#6:17](-[#8:18]):[#6:16]2:[#6:4](:[#6:5]:[#6:6](:[#8:13]:[#6:14]:2=[#8:15])-[#6:7]-[#6@@:8](-[#6:10](-[Cl:12])-[Cl:11])/[#8:9]):[#6:3]:1>>[#8:1](-[#6])-[#6:2]1:[#6:19]:[#6:17](-[#8:18]):[#6:16]2:[#6:4](:[#6:5]:[#6:6](:[#8:13]:[#6:14]:2=[#8:15])-[#6:7]-[#6@@:8](-[#6:10](-[Cl:12])-[Cl:11])/[#8:9]):[#6:3]:1", + "reactions": [ + { + "substrate": "O=c1oc(C[C@H](O)C(Cl)Cl)cc2cc(O)cc(O)c12", + "products": [ + "COc1cc(O)c2c(=O)oc(C[C@H](O)C(Cl)Cl)cc2c1" + ], + "isIntermediate": false, + "description": "AoiQ-MT domain can catalyze both O-6 and O-8 methylations to produce 8-methyldichlorodiaporthin, whereas NgvF can catalyze only O-6 methylation to produce dichlorodiaporthin" + } + ], + "evidence": { + "evidenceCode": [ + "Heterologous expression", + "In vitro assay" + ], + "references": [ + "doi:10.1021/jacs.1c02868" + ] + } + } + ] +} \ No newline at end of file