Skip to content
Open
Changes from all commits
Commits
File filter

Filter by extension

Filter by extension

Conversations
Failed to load comments.
Loading
Jump to
Jump to file
Failed to load files.
Loading
Diff view
Diff view
55 changes: 55 additions & 0 deletions mite_data/data/d47cb808-b45f-11f1-b4b1-cf84655b59e7.json
Original file line number Diff line number Diff line change
@@ -0,0 +1,55 @@
{
"accession": "MITE9999999",
"status": "pending",
"comment": "ApyS catalyzes methylation of the \u03b2-carbon of the aminopyruvic acid to complete the C-terminal \u03b2-methylated aminopyruvate group during aminopyruvatide biosynthesis.",
"changelog": [
{
"version": "1",
"date": "2026-09-19",
"contributors": [
"0009-0008-8086-5325"
],
"reviewers": [
"BBBBBBBBBBBBBBBBBBBBBBBB"
],
"comment": "New entry."
}
],
"enzyme": {
"name": "ApyS",
"description": "Methyltransferase",
"references": [
"doi:10.1021/acscentsci.4c00088"
],
"databaseIds": {
"uniprot": "UPI0000667567",
"genpept": "ABC34725.1"
}
},
"reactions": [
{
"tailoring": [
"Methylation"
],
"description": "ApyS catalyzes methylation of the \u03b2-carbon of the aminopyruvic acid generated by ApyH/ApyI to form a C-terminal 3-amino-2-oxobutanoic acid",
"reactionSMARTS": "[#6:1]-[#6:2]-[#6:3](-[#6:5](-[#6:267](-[#7:269]-[#6:270](-[#6:276](-[#7:278]-[#6:279](-[#6:285](-[#7:287]-[#6:288](-[#6:291](-[#7:293]-[#6:294](-[#6:299](-[#7:301]-[#6:302](-[#6:308](-[#7:310]-[#6:311](-[#6:316](-[#7:318]-[#6:319]-[#6:320](-[#7:322]-[#6:323](-[#6:329](-[#7:331]-[#6:332](-[#6:337](-[#7:339]-[#6:340](-[#6:493](-[#8:495])-[#6:494])-[#6:341](-[#7:343]-[#6:344](-[#6:489](-[#6:491]-[#6:492])-[#6:490])-[#6:345](-[#7:347]-[#6:348](-[#6:486](-[#8:488])-[#6:487])-[#6:349](-[#7:351]-[#6:352](-[#6:357](-[#7:359]-[#6:360](-[#6:363](-[#7:365]-[#6:366](-[#6:372](-[#7:374]-[#6:375](-[#6:483](-[#6:485])-[#6:484])-[#6:376](-[#7:378]-[#6:379](-[#6:384](-[#7:386]-[#6:387](-[#6:392](-[#7:394]-[#6:395](-[#6:397](-[#7:399]-[#6:400]-[#6:401](-[#7:403]-[#6:404]-[#6:405](-[#7:407]-[#6:408](-[#6:416](-[#7:418]-[#6:419](-[#6:424](-[#7:426]-[#6:427]-[#6:428](-[#7:430]-[#6:431](-[#6:437](-[#7:439]-[#6:440]-[#6:441](-[#7:443]-[#6:444]1-[#6:481](=[#8:482])-[#7:480]-[#6:475](-[#6:476]-[#6:477](-[#6:479])-[#6:478])-[#6:473](=[#8:474])-[#7:472]-[#6:462](-[#6:463](-[#7:465]-[#6:466]-[#6:467](-[#6:469](-[#8:471])=[#8:470])=[#8:468])=[#8:464])-[#6:460](-[#6:461])-[#6:455]2:[#6:456]:[#6:457]:[#6:458](-[#8:459]):[#6:453](:[#6:454]:2)-[#6:451]2:[#6:452]:[#6:446](:[#6:447]:[#6:448]:[#6:449]:2-[#8:450])-[#6:445]-1)=[#8:442])=[#8:438])-[#6:432]-[#6:433]-[#6:434](-[#8:436])=[#8:435])=[#8:429])=[#8:425])-[#6:420]-[#6:421]-[#16:422]-[#6:423])=[#8:417])-[#6:409]-[#6:410]-[#6:411]-[#7:412]-[#6:413](-[#7:415])=[#7:414])=[#8:406])=[#8:402])=[#8:398])-[#6:396])=[#8:393])-[#6:388]-[#6:389](-[#6:391])-[#6:390])=[#8:385])-[#6:380]-[#6:381](-[#8:383])=[#8:382])=[#8:377])=[#8:373])-[#6:367]-[#6:368]-[#6:369]-[#6:370]-[#7:371])=[#8:364])-[#6:361]-[#8:362])=[#8:358])-[#6:353]-[#6:354]-[#16:355]-[#6:356])=[#8:350])=[#8:346])=[#8:342])=[#8:338])-[#6:333]-[#6:334](-[#6:336])-[#6:335])=[#8:330])-[#6:324]-[#6:325]-[#6:326]-[#6:327]-[#7:328])=[#8:321])=[#8:317])-[#6:312]-[#6:313](=[#8:315])-[#7:314])=[#8:309])-[#6:303]-[#6:304]-[#6:305](-[#8:307])=[#8:306])=[#8:300])-[#6:295]-[#6:296](-[#6:298])-[#6:297])=[#8:292])-[#6:289]-[#16:290])=[#8:286])-[#6:280]-[#6:281]-[#6:282]-[#6:283]-[#7:284])=[#8:277])-[#6:271]-[#6:272]-[#6:273](=[#8:275])-[#7:274])=[#8:268])-[#7:6]-[#6:7](-[#6:9](-[#7:11]-[#6:12](-[#6:14](-[#7:20]-[#6:21](-[#6:23](-[#6:263](-[#6:265]-[#6:266])-[#6:264])-[#7:24]-[#6:25](-[#6:27](-[#7:33]-[#6:34](-[#6:36](-[#7:42]-[#6:43](-[#6:45](-[#7:47]-[#6:48](-[#6:50](-[#7:55]-[#6:56](-[#6:58](-[#6:260](-[#6:262])-[#6:261])-[#7:59]-[#6:60](-[#6:62]1-[#7:66](-[#6:67](-[#6:69](-[#7:74]-[#6:75](-[#6:77](-[#7:82]-[#6:83](-[#6:85](-[#7:90]-[#6:91](-[#6:93](-[#6:257](-[#8:259])-[#6:258])-[#7:94]-[#6:95](-[#6:97](-[#7:102]-[#6:103](-[#6:105](-[#7:111]-[#6:112](-[#6:114]2-[#7:118](-[#6:119](-[#6:121](-[#7:126]-[#6:127](-[#6:129](-[#7:135]-[#6:136](-[#6:138]-[#7:139]-[#6:140](-[#6:142](-[#7:148]-[#6:149](-[#6:151](-[#6:253](-[#6:255]-[#6:256])-[#6:254])-[#7:152]-[#6:153](-[#6:155](-[#7:158]-[#6:159](-[#6:161](-[#6:250](-[#6:252])-[#6:251])-[#7:162]-[#6:163](-[#6:165](-[#7:168]-[#6:169](-[#6:171](-[#6:247](-[#6:249])-[#6:248])-[#7:172]-[#6:173](-[#6:175]-[#7:176]-[#6:177](-[#6:179](-[#7:185]-[#6:186](-[#6:188](-[#6:244](-[#8:246])-[#6:245])-[#7:189]-[#6:190](-[#6:192](-[#7:198]-[#6:199](-[#6:201](-[#7:207]-[#6:208](-[#6:210]3-[#7:214](-[#6:215](-[#6:217](-[#7:223]-[#6:224](-[#6:226](-[#6:241](-[#8:243])-[#6:242])-[#7:227]-[#6:228](-[#6:230](-[#7:232]-[#6:233](-[#6:235](-[#6:237]-[#6:238]-[#16:239]-[#6:240])-[#7:236])=[#8:234])-[#6:231])=[#8:229])=[#8:225])-[#6:218]-[#6:219]-[#6:220]-[#6:221]-[#7:222])=[#8:216])-[#6:213]-[#6:212]-[#6:211]-3)=[#8:209])-[#6:202]-[#6:203]-[#6:204]-[#6:205]-[#7:206])=[#8:200])-[#6:193]-[#6:194]-[#6:195]-[#6:196]-[#7:197])=[#8:191])=[#8:187])-[#6:180]-[#6:181]-[#6:182]-[#6:183]-[#7:184])=[#8:178])=[#8:174])=[#8:170])-[#6:166]-[#8:167])=[#8:164])=[#8:160])-[#6:156]-[#8:157])=[#8:154])=[#8:150])-[#6:143]-[#6:144]-[#6:145](-[#8:147])=[#8:146])=[#8:141])=[#8:137])-[#6:130]-[#6:131]-[#6:132]-[#6:133]-[#7:134])=[#8:128])-[#6:122]-[#6:123](-[#6:125])-[#6:124])=[#8:120])-[#6:117]-[#6:116]-[#6:115]-2)=[#8:113])-[#6:106]-[#6:107]-[#6:108]-[#6:109]-[#7:110])=[#8:104])-[#6:98]-[#6:99]-[#16:100]-[#6:101])=[#8:96])=[#8:92])-[#6:86]-[#6:87](-[#6:89])-[#6:88])=[#8:84])-[#6:78]-[#6:79](-[#8:81])=[#8:80])=[#8:76])-[#6:70]-[#6:71]-[#16:72]-[#6:73])=[#8:68])-[#6:65]-[#6:64]-[#6:63]-1)=[#8:61])=[#8:57])-[#6:51]-[#6:52](-[#8:54])=[#8:53])=[#8:49])-[#6:46])=[#8:44])-[#6:37]-[#6:38]-[#6:39]-[#6:40]-[#7:41])=[#8:35])-[#6:28]-[#6:29]-[#6:30]-[#6:31]-[#7:32])=[#8:26])=[#8:22])-[#6:15]-[#6:16]-[#6:17]-[#6:18]-[#7:19])=[#8:13])-[#6:10])=[#8:8])-[#6:4]>>[#6:1]-[#6:2]-[#6:3](-[#6:5](-[#6:267](-[#7:269]-[#6:270](-[#6:276](-[#7:278]-[#6:279](-[#6:285](-[#7:287]-[#6:288](-[#6:291](-[#7:293]-[#6:294](-[#6:299](-[#7:301]-[#6:302](-[#6:308](-[#7:310]-[#6:311](-[#6:316](-[#7:318]-[#6:319]-[#6:320](-[#7:322]-[#6:323](-[#6:329](-[#7:331]-[#6:332](-[#6:337](-[#7:339]-[#6:340](-[#6:493](-[#8:495])-[#6:494])-[#6:341](-[#7:343]-[#6:344](-[#6:489](-[#6:491]-[#6:492])-[#6:490])-[#6:345](-[#7:347]-[#6:348](-[#6:486](-[#8:488])-[#6:487])-[#6:349](-[#7:351]-[#6:352](-[#6:357](-[#7:359]-[#6:360](-[#6:363](-[#7:365]-[#6:366](-[#6:372](-[#7:374]-[#6:375](-[#6:483](-[#6:485])-[#6:484])-[#6:376](-[#7:378]-[#6:379](-[#6:384](-[#7:386]-[#6:387](-[#6:392](-[#7:394]-[#6:395](-[#6:397](-[#7:399]-[#6:400]-[#6:401](-[#7:403]-[#6:404]-[#6:405](-[#7:407]-[#6:408](-[#6:416](-[#7:418]-[#6:419](-[#6:424](-[#7:426]-[#6:427]-[#6:428](-[#7:430]-[#6:431](-[#6:437](-[#7:439]-[#6:440]-[#6:441](-[#7:443]-[#6:444]1-[#6:481](=[#8:482])-[#7:480]-[#6:475](-[#6:476]-[#6:477](-[#6:479])-[#6:478])-[#6:473](=[#8:474])-[#7:472]-[#6:462](-[#6:463](-[#7:465]-[#6:466](-[#6])-[#6:467](-[#6:469](-[#8:471])=[#8:470])=[#8:468])=[#8:464])-[#6:460](-[#6:461])-[#6:455]2:[#6:456]:[#6:457]:[#6:458](-[#8:459]):[#6:453](:[#6:454]:2)-[#6:451]2:[#6:452]:[#6:446](:[#6:447]:[#6:448]:[#6:449]:2-[#8:450])-[#6:445]-1)=[#8:442])=[#8:438])-[#6:432]-[#6:433]-[#6:434](-[#8:436])=[#8:435])=[#8:429])=[#8:425])-[#6:420]-[#6:421]-[#16:422]-[#6:423])=[#8:417])-[#6:409]-[#6:410]-[#6:411]-[#7:412]-[#6:413](-[#7:415])=[#7:414])=[#8:406])=[#8:402])=[#8:398])-[#6:396])=[#8:393])-[#6:388]-[#6:389](-[#6:390])-[#6:391])=[#8:385])-[#6:380]-[#6:381](-[#8:383])=[#8:382])=[#8:377])=[#8:373])-[#6:367]-[#6:368]-[#6:369]-[#6:370]-[#7:371])=[#8:364])-[#6:361]-[#8:362])=[#8:358])-[#6:353]-[#6:354]-[#16:355]-[#6:356])=[#8:350])=[#8:346])=[#8:342])=[#8:338])-[#6:333]-[#6:334](-[#6:336])-[#6:335])=[#8:330])-[#6:324]-[#6:325]-[#6:326]-[#6:327]-[#7:328])=[#8:321])=[#8:317])-[#6:312]-[#6:313](=[#8:315])-[#7:314])=[#8:309])-[#6:303]-[#6:304]-[#6:305](-[#8:307])=[#8:306])=[#8:300])-[#6:295]-[#6:296](-[#6:297])-[#6:298])=[#8:292])-[#6:289]-[#16:290])=[#8:286])-[#6:280]-[#6:281]-[#6:282]-[#6:283]-[#7:284])=[#8:277])-[#6:271]-[#6:272]-[#6:273](=[#8:275])-[#7:274])=[#8:268])-[#7:6]-[#6:7](-[#6:9](-[#7:11]-[#6:12](-[#6:14](-[#7:20]-[#6:21](-[#6:23](-[#6:263](-[#6:265]-[#6:266])-[#6:264])-[#7:24]-[#6:25](-[#6:27](-[#7:33]-[#6:34](-[#6:36](-[#7:42]-[#6:43](-[#6:45](-[#7:47]-[#6:48](-[#6:50](-[#7:55]-[#6:56](-[#6:58](-[#6:260](-[#6:261])-[#6:262])-[#7:59]-[#6:60](-[#6:62]1-[#7:66](-[#6:67](-[#6:69](-[#7:74]-[#6:75](-[#6:77](-[#7:82]-[#6:83](-[#6:85](-[#7:90]-[#6:91](-[#6:93](-[#6:257](-[#8:259])-[#6:258])-[#7:94]-[#6:95](-[#6:97](-[#7:102]-[#6:103](-[#6:105](-[#7:111]-[#6:112](-[#6:114]2-[#7:118](-[#6:119](-[#6:121](-[#7:126]-[#6:127](-[#6:129](-[#7:135]-[#6:136](-[#6:138]-[#7:139]-[#6:140](-[#6:142](-[#7:148]-[#6:149](-[#6:151](-[#6:253](-[#6:255]-[#6:256])-[#6:254])-[#7:152]-[#6:153](-[#6:155](-[#7:158]-[#6:159](-[#6:161](-[#6:250](-[#6:251])-[#6:252])-[#7:162]-[#6:163](-[#6:165](-[#7:168]-[#6:169](-[#6:171](-[#6:247](-[#6:249])-[#6:248])-[#7:172]-[#6:173](-[#6:175]-[#7:176]-[#6:177](-[#6:179](-[#7:185]-[#6:186](-[#6:188](-[#6:244](-[#8:246])-[#6:245])-[#7:189]-[#6:190](-[#6:192](-[#7:198]-[#6:199](-[#6:201](-[#7:207]-[#6:208](-[#6:210]3-[#7:214](-[#6:215](-[#6:217](-[#7:223]-[#6:224](-[#6:226](-[#6:241](-[#8:243])-[#6:242])-[#7:227]-[#6:228](-[#6:230](-[#7:232]-[#6:233](-[#6:235](-[#6:237]-[#6:238]-[#16:239]-[#6:240])-[#7:236])=[#8:234])-[#6:231])=[#8:229])=[#8:225])-[#6:218]-[#6:219]-[#6:220]-[#6:221]-[#7:222])=[#8:216])-[#6:213]-[#6:212]-[#6:211]-3)=[#8:209])-[#6:202]-[#6:203]-[#6:204]-[#6:205]-[#7:206])=[#8:200])-[#6:193]-[#6:194]-[#6:195]-[#6:196]-[#7:197])=[#8:191])=[#8:187])-[#6:180]-[#6:181]-[#6:182]-[#6:183]-[#7:184])=[#8:178])=[#8:174])=[#8:170])-[#6:166]-[#8:167])=[#8:164])=[#8:160])-[#6:156]-[#8:157])=[#8:154])=[#8:150])-[#6:143]-[#6:144]-[#6:145](-[#8:147])=[#8:146])=[#8:141])=[#8:137])-[#6:130]-[#6:131]-[#6:132]-[#6:133]-[#7:134])=[#8:128])-[#6:122]-[#6:123](-[#6:124])-[#6:125])=[#8:120])-[#6:117]-[#6:116]-[#6:115]-2)=[#8:113])-[#6:106]-[#6:107]-[#6:108]-[#6:109]-[#7:110])=[#8:104])-[#6:98]-[#6:99]-[#16:100]-[#6:101])=[#8:96])=[#8:92])-[#6:86]-[#6:87](-[#6:88])-[#6:89])=[#8:84])-[#6:78]-[#6:79](-[#8:81])=[#8:80])=[#8:76])-[#6:70]-[#6:71]-[#16:72]-[#6:73])=[#8:68])-[#6:65]-[#6:64]-[#6:63]-1)=[#8:61])=[#8:57])-[#6:51]-[#6:52](-[#8:54])=[#8:53])=[#8:49])-[#6:46])=[#8:44])-[#6:37]-[#6:38]-[#6:39]-[#6:40]-[#7:41])=[#8:35])-[#6:28]-[#6:29]-[#6:30]-[#6:31]-[#7:32])=[#8:26])=[#8:22])-[#6:15]-[#6:16]-[#6:17]-[#6:18]-[#7:19])=[#8:13])-[#6:10])=[#8:8])-[#6:4]",
"reactions": [
{
"substrate": "CCC(C)C(NC(=O)C(C)NC(=O)C(CCCCN)NC(=O)C(NC(=O)C(CCCCN)NC(=O)C(CCCCN)NC(=O)C(C)NC(=O)C(CC(=O)O)NC(=O)C(NC(=O)C1CCCN1C(=O)C(CCSC)NC(=O)C(CC(=O)O)NC(=O)C(CC(C)C)NC(=O)C(NC(=O)C(CCSC)NC(=O)C(CCCCN)NC(=O)C1CCCN1C(=O)C(CC(C)C)NC(=O)C(CCCCN)NC(=O)CNC(=O)C(CCC(=O)O)NC(=O)C(NC(=O)C(CO)NC(=O)C(NC(=O)C(CO)NC(=O)C(NC(=O)CNC(=O)C(CCCCN)NC(=O)C(NC(=O)C(CCCCN)NC(=O)C(CCCCN)NC(=O)C1CCCN1C(=O)C(CCCCN)NC(=O)C(NC(=O)C(C)NC(=O)C(N)CCSC)C(C)O)C(C)O)C(C)C)C(C)C)C(C)CC)C(C)O)C(C)C)C(C)CC)C(=O)NC(CCC(N)=O)C(=O)NC(CCCCN)C(=O)NC(CS)C(=O)NC(CC(C)C)C(=O)NC(CCC(=O)O)C(=O)NC(CC(N)=O)C(=O)NCC(=O)NC(CCCCN)C(=O)NC(CC(C)C)C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(CCSC)C(=O)NC(CO)C(=O)NC(CCCCN)C(=O)NC(C(=O)NC(CC(=O)O)C(=O)NC(CC(C)C)C(=O)NC(C)C(=O)NCC(=O)NCC(=O)NC(CCCNC(=N)N)C(=O)NC(CCSC)C(=O)NCC(=O)NC(CCC(=O)O)C(=O)NCC(=O)NC1Cc2ccc(O)c(c2)-c2cc(ccc2O)C(C)C(C(=O)NCC(=O)C(=O)O)NC(=O)C(CC(C)C)NC1=O)C(C)C)C(C)O)C(C)CC)C(C)O",
"products": [
"CCC(C)C(NC(=O)C(C)NC(=O)C(CCCCN)NC(=O)C(NC(=O)C(CCCCN)NC(=O)C(CCCCN)NC(=O)C(C)NC(=O)C(CC(=O)O)NC(=O)C(NC(=O)C1CCCN1C(=O)C(CCSC)NC(=O)C(CC(=O)O)NC(=O)C(CC(C)C)NC(=O)C(NC(=O)C(CCSC)NC(=O)C(CCCCN)NC(=O)C1CCCN1C(=O)C(CC(C)C)NC(=O)C(CCCCN)NC(=O)CNC(=O)C(CCC(=O)O)NC(=O)C(NC(=O)C(CO)NC(=O)C(NC(=O)C(CO)NC(=O)C(NC(=O)CNC(=O)C(CCCCN)NC(=O)C(NC(=O)C(CCCCN)NC(=O)C(CCCCN)NC(=O)C1CCCN1C(=O)C(CCCCN)NC(=O)C(NC(=O)C(C)NC(=O)C(N)CCSC)C(C)O)C(C)O)C(C)C)C(C)C)C(C)CC)C(C)O)C(C)C)C(C)CC)C(=O)NC(CCC(N)=O)C(=O)NC(CCCCN)C(=O)NC(CS)C(=O)NC(CC(C)C)C(=O)NC(CCC(=O)O)C(=O)NC(CC(N)=O)C(=O)NCC(=O)NC(CCCCN)C(=O)NC(CC(C)C)C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(CCSC)C(=O)NC(CO)C(=O)NC(CCCCN)C(=O)NC(C(=O)NC(CC(=O)O)C(=O)NC(CC(C)C)C(=O)NC(C)C(=O)NCC(=O)NCC(=O)NC(CCCNC(=N)N)C(=O)NC(CCSC)C(=O)NCC(=O)NC(CCC(=O)O)C(=O)NCC(=O)NC1Cc2ccc(O)c(c2)-c2cc(ccc2O)C(C)C(C(=O)NC(C)C(=O)C(=O)O)NC(=O)C(CC(C)C)NC1=O)C(C)C)C(C)O)C(C)CC)C(C)O"
],
"isIntermediate": false
}
],
"evidence": {
"evidenceCode": [
"Heterologous expression"
],
"references": [
"doi:10.1021/acscentsci.4c00088"
]
}
}
]
}
Loading