Contributor submission RSAD2

mite_data/data/5af77cd4-38a9-11f1-8f25-9b0d34c97d5b.json

@@ -0,0 +1,65 @@
+{
+    "accession": "MITE9999999",
+    "status": "pending",
+    "comment": "Radical SAM catalyzes formal dehydration of CTP to afford anti-viral ddhCTP",
+    "changelog": [
+        {
+            "version": "1",
+            "date": "2026-04-15",
+            "contributors": [
+                "0000-0003-2971-646X"
+            ],
+            "reviewers": [
+                "BBBBBBBBBBBBBBBBBBBBBBBB"
+            ],
+            "comment": "New entry."
+        }
+    ],
+    "enzyme": {
+        "name": "RSAD2",
+        "description": "Radical S-adenosyl methionine",
+        "references": [
+            "doi:10.1038/s41586-018-0238-4"
+        ],
+        "databaseIds": {
+            "uniprot": "O70600",
+            "genpept": "CAA68971.1"
+        },
+        "cofactors": {
+            "organic": [
+                "SAM"
+            ],
+            "inorganic": [
+                "FeS"
+            ]
+        }
+    },
+    "reactions": [
+        {
+            "tailoring": [
+                "Dehydration"
+            ],
+            "description": "Formal dehydration of CTP to afford anti-viral ddhCTP",
+            "reactionSMARTS": "[#6:1]1:[#6:7](-[#7:8]):[#7:6]:[#6:4](=[#8:5]):[#7:3](/[#6@@:9]2-[#8:13]-[#6@:12](/[#6:14]-[#8:15]-[#15@@:16](-[#8:19]-[#15@@:20](-[#8:23]-[#15:24](-[#8:27])(-[#8:26])=[#8:25])(\\[#8:22])=[#8:21])(\\[#8:18])=[#8:17])-[#6@@:11](\\[#8])-[#6@:10]-2\\[#8:29]):[#6:2]:1>>[#6:1]1:[#6:7](-[#7:8]):[#7:6]:[#6:4](=[#8:5]):[#7:3](/[#6@@:9]2-[#8:13]-[#6:12](-[#6:14]-[#8:15]-[#15@@:16](-[#8:19]-[#15@@:20](-[#8:23]-[#15:24](-[#8:27])(-[#8:26])=[#8:25])(\\[#8:22])=[#8:21])(\\[#8:18])=[#8:17])=[#6:11]-[#6@:10]-2\\[#8:29]):[#6:2]:1",
+            "reactions": [
+                {
+                    "substrate": "Nc1ccn(C2OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)n1",
+                    "products": [
+                        "Nc1ccn(C2OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)=CC2O)c(=O)n1"
+                    ],
+                    "isIntermediate": true
+                }
+            ],
+            "evidence": {
+                "evidenceCode": [
+                    "Heterologous expression",
+                    "Inference from genomic data and chemical structure",
+                    "In vitro assay"
+                ],
+                "references": [
+                    "doi:10.1038/s41586-018-0238-4"
+                ]
+            }
+        }
+    ]
+}