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EVODEX.1-R527

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

[H][C@:6]1([C@:4]([C@:2]([C:1]([H:43])([H:44])[H:45])([O:3][H:31])[H:42])([O:5][H:32])[H:41])[C:7]([H:34])([H:35])[N:8]([H:36])[C:9]2:[N:10]([H:37]):[C:11](=[N:12][H:38]):[N:13]([H:39]):[C:14](=[O:15]):[C:16]:2[N:17]1[H].[H][C:20]([C@:19]([N:18]([H:53])[H:54])([C:26](=[O:27])[O:28][H:51])[H:52])([S:21][C:22]([C:23](=[O:24])[O:25][H:46])([H:47])[H:48])[H:49].[O:29]=[O:30]>>[C:1]([C@:2]([O:3][H:31])([C@:4]([O:5][H:32])([C:6]1=[N:17][C:16]2:[C:9](:[N:10]([H:37]):[C:11](=[N:12][H:38]):[N:13]([H:39]):[C:14]:2=[O:15])[N:8]([H:36])[C:7]1([H:34])[H:35])[H:41])[H:42])([H:43])([H:44])[H:45].[H][O:29][C:20]([C@:19]([N:18]([H:53])[H:54])([C:26](=[O:27])[O:28][H:51])[H:52])([S:21][C:22]([C:23](=[O:24])[O:25][H:46])([H:47])[H:48])[H:49].[H][O:30][H]

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
53852 (S)-carboxymethyl-L-cysteine + 5,6,7,8-tetrahydrobiopterin + O2 = (S)-carboxymethyl-L-cysteine S-oxide + dihydrobiopterin + H2O False Homo sapiens P00439 swissprot 1.14.16.1

Derived Partial Reactions

EVODEX.1-P550

[H][C:20]([C@:19]([N:18]([H:53])[H:54])([C:26](=[O:27])[O:28][H:51])[H:52])([S:21][C:22]([C:23](=[O:24])[O:25][H:46])([H:47])[H:48])[H:49]>>[H]O[C:20]([C@:19]([N:18]([H:53])[H:54])([C:26](=[O:27])[O:28][H:51])[H:52])([S:21][C:22]([C:23](=[O:24])[O:25][H:46])([H:47])[H:48])[H:49]

[H][C:20]([C@:19]([N:18]([H:53])[H:54])([C:26](=[O:27])[O:28][H:51])[H:52])([S:21][C:22]([C:23](=[O:24])[O:25][H:46])([H:47])[H:48])[H:49]>>[H]O[C:20]([C@:19]([N:18]([H:53])[H:54])([C:26](=[O:27])[O:28][H:51])[H:52])([S:21][C:22]([C:23](=[O:24])[O:25][H:46])([H:47])[H:48])[H:49]