| Entry |
|
|---|
| Name |
5-Iodo-2,3-dimethoxyorsellinate-[acp];
4-Hydroxy-5-iodo-2,3-dimethoxy-6-methylbenzoate-[acp]
|
|---|
| Formula |
C10H10IO4SR
|
|---|
| Structure |
|
|---|
| Reaction |
|
|---|
| Pathway |
| map01059 | Biosynthesis of enediyne antibiotics |
| map01110 | Biosynthesis of secondary metabolites |
|
|---|
| Module |
| M00833 | Calicheamicin biosynthesis, calicheamicinone => calicheamicin |
| M00834 | Calicheamicin orsellinate moiety biosynthesis, malonyl-CoA => orsellinate-ACP => 5-iodo-2,3-dimethoxyorsellinate-ACP |
|
|---|
| Enzyme |
2.1.1.-
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 17
1 S2a S 12.9500 -19.1800
2 C8y C 8.1200 -19.1800
3 C8y C 8.1200 -20.5800
4 C8y C 9.3100 -21.2800
5 C8y C 10.5700 -20.5800
6 C8y C 10.5700 -19.1800
7 C8y C 9.3100 -18.4800
8 C5a C 11.7600 -18.4800
9 O5a O 11.7600 -17.0800
10 C1a C 9.3100 -17.0800
11 O2a O 11.7600 -21.2800
12 O1a O 6.9300 -21.2800
13 C1a C 12.9781 -20.5899
14 X I 6.9047 -18.4849
15 O2a O 9.2928 -22.6799
16 C1a C 10.5092 -23.4024
17 R R 14.3500 -19.1800
BOND 17
1 2 3 2
2 3 4 1
3 4 5 2
4 5 6 1
5 6 7 2
6 2 7 1
7 6 8 1
8 8 1 1
9 8 9 2
10 7 10 1
11 5 11 1
12 3 12 1
13 11 13 1
14 2 14 1
15 4 15 1
16 15 16 1
17 1 17 1
|
|---|
