{
    "accession": "MITE0000149",
    "comment": "Previously referenced retired MIBiG ID BGC0003008.",
    "status": "active",
    "changelog": [
        {
            "version": "1",
            "date": "2024-07-30",
            "contributors": [
                "0000-0002-9152-2562"
            ],
            "reviewers": [
                "0000-0001-6534-6609",
                "0000-0003-0443-9902"
            ],
            "comment": "Initial entry. Reviewer partially fixed reactionSMARTS:reactionSMARTS, validation still not passing. Reviewer partially fixed reactions:products, validation still not passing. Reviewer 1 fixed numbering of reaction SMARTS, reaction passes."
        },
        {
            "version": "2",
            "date": "2025-12-29",
            "contributors": [
                "AAAAAAAAAAAAAAAAAAAAAAAA"
            ],
            "reviewers": [
                "0000-0001-6534-6609"
            ],
            "comment": "Fixed enzyme description, added reaction description."
        },
        {
            "version": "3",
            "date": "2026-07-03",
            "contributors": [
                "AAAAAAAAAAAAAAAAAAAAAAAA"
            ],
            "reviewers": [
                "0000-0001-6534-6609"
            ],
            "comment": "Removed retired MIBIG ID."
        }
    ],
    "enzyme": {
        "name": "MciB",
        "description": "Cytochrome P450",
        "references": [
            "doi:10.1002/anie.202311533"
        ],
        "databaseIds": {
            "uniprot": "A0A1C6TS88",
            "genpept": "SCL44650.1"
        }
    },
    "reactions": [
        {
            "tailoring": [
                "Biaryl bond formation"
            ],
            "description": "Macrocyclisation of Tyr-Trp via biaryl bond formation.",
            "reactionSMARTS": "[#6:1]-[#6:2](-[#6:4]/[#6@@:5](-[#6:12](-[#7:14]-[#6@:15](-[#6:17](-[#7:19]-[#6:20]-[#6:21](-[#7:23]-[#6@:24](-[#6:26](-[#7:28]\\[#6@:29](-[#6:38](-[#7:40]1-[#6@:44](/[#6:45](-[#7:47]/[#6@:48](-[#6:59](-[#7:61]/[#6@:62](-[#6:69](-[#8:71])=[#8:70])-[#6:63]-[#6:64]2:[nH:68]:[#6:67]:[#7:66]:[#6:65]:2)=[#8:60])-[#6:49]-[#6:50]2:[#6:58]3:[#6:53](:[#6:54]:[#6:55]:[#6:56]:[#6:57]:3):[nH:52]:[#6:51]:2)=[#8:46])-[#6:43]-[#6:42]-[#6:41]-1)=[#8:39])-[#6:30]-[#6:31]1:[#6:37]:[#6:36]:[#6:34](-[#8:35]):[#6:33]:[#6:32]:1)=[#8:27])\\[#6:25])=[#8:22])=[#8:18])\\[#6:16])=[#8:13])-[#7:6]-[#6:7](-[#6@@:9](/[#7:11])-[#6:10])=[#8:8])-[#6:3]>>[#6:3]-[#6:2](-[#6:4]/[#6@@:5](-[#6:12](-[#7:14]-[#6@:15](-[#6:17](-[#7:19]-[#6:20]-[#6:21](-[#7:23]-[#6@:24](-[#6:26](-[#7:28]\\[#6@@:29]1-[#6:38](-[#7:40]2-[#6@:44](/[#6:45](-[#7:47]/[#6@:48](-[#6:59](-[#7:61]/[#6@:62](-[#6:69](-[#8:71])=[#8:70])-[#6:63]-[#6:64]3:[nH:68]:[#6:67]:[#7:66]:[#6:65]:3)=[#8:60])-[#6:49]-[#6:50]3:[#6:58]4:[#6:53](:[#6:54]:[#6:55]:[#6:56](-[#6:33]5:[#6:32]:[#6:31](:[#6:37]:[#6:36]:[#6:34]:5-[#8:35])-[#6:30]-1):[#6:57]:4):[nH:52]:[#6:51]:3)=[#8:46])-[#6:43]-[#6:42]-[#6:41]-2)=[#8:39])=[#8:27])\\[#6:25])=[#8:22])=[#8:18])\\[#6:16])=[#8:13])-[#7:6]-[#6:7](-[#6@@:9](/[#7:11])-[#6:10])=[#8:8])-[#6:1]",
            "reactions": [
                {
                    "substrate": "CC(C)C[C@H](NC(=O)[C@H](C)N)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)O",
                    "products": [
                        "CC(C)C[C@H](NC(=O)[C@H](C)N)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@H]1Cc2ccc(O)c(c2)-c2ccc3[nH]cc(c3c2)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)O)NC(=O)[C@@H]2CCCN2C1=O"
                    ],
                    "isIntermediate": false,
                    "description": "Macrocyclisation of the MciA precursor peptide."
                }
            ],
            "evidence": {
                "evidenceCode": [
                    "In vitro assay"
                ],
                "references": [
                    "doi:10.1002/anie.202311533"
                ]
            }
        }
    ]
}