Entry |
|
Name |
|
Formula |
C39H63N5O12
|
Exact mass |
793.4473
|
Mol weight |
793.9438
|
Structure |
|
Sequence |
0 Mak 1 Mte 2 Mak 3 Man 4 Gly 5 Mak 6 Mtk 7 Mak 8 Mae 9 Mad 10 Mad 11 Mad 12 Man |
Gene |
|
Organism |
Theonella swinhoei (most likelly Pseudomonas sp.) |
Type |
PKNRP |
Other DBs |
|
LinkDB |
|
KCF data |
ATOM 56
1 O2x O 29.5717 -27.8064
2 C1x C 29.5717 -29.2079
3 O2x O 30.7854 -29.9086
4 C1y C 31.9992 -29.2079
5 C1y C 31.9992 -27.8064
6 C1y C 30.7854 -27.1056
7 C1y C 33.2129 -29.9086
8 C1z C 34.4267 -29.2079
9 C1y C 34.4267 -27.8064
10 O2x O 33.2129 -27.1056
11 C1b C 35.6207 -27.1056
12 C1c C 36.8345 -27.8064
13 C1b C 38.0482 -27.1056
14 C1b C 39.2619 -27.8064
15 C1b C 40.4757 -27.1056
16 C2b C 41.6894 -27.8064
17 C2b C 42.9031 -27.1056
18 C2b C 44.1169 -27.8064
19 C2b C 45.3306 -27.1056
20 C2b C 46.5444 -27.8064
21 C2b C 47.7582 -27.1056
22 C5a C 48.9719 -27.8064
23 N1b N 50.1857 -27.1056
24 C1c C 51.3994 -27.8064
25 C1b C 52.6131 -27.1056
26 O1a O 36.8345 -29.2077
27 O5a O 48.9719 -29.2079
28 C6a C 51.3994 -29.2075
29 O6a O 50.1602 -29.9233
30 O6a O 52.5875 -29.8936
31 C1b C 53.8369 -27.8123
32 C1b C 55.0388 -27.1182
33 N1b N 56.2249 -27.8029
34 C2c C 57.4188 -27.1135
35 N1a N 58.6088 -27.8005
36 N2a N 57.4188 -25.7044
37 N1b N 30.7854 -25.7041
38 C5a C 29.5550 -24.9935
39 C1c C 29.5550 -23.5920
40 O5a O 28.3497 -25.6895
41 O1a O 30.7769 -22.8864
42 C1z C 28.3580 -22.9011
43 O2x O 28.3579 -21.4997
44 C1y C 27.1442 -20.7990
45 C1y C 25.9304 -21.4998
46 C2y C 25.9305 -22.9012
47 C1x C 27.1443 -23.6018
48 O2a O 29.5717 -22.2003
49 C1a C 29.5675 -20.7988
50 C1a C 27.1441 -19.3975
51 C1a C 24.7146 -20.7979
52 C2a C 24.7148 -23.6031
53 C1a C 34.7895 -30.5616
54 O2a O 33.2129 -31.3101
55 C1a C 34.4288 -32.0121
56 C1a C 35.7804 -28.8452
BOND 58
1 1 2 1
2 2 3 1
3 4 3 1 #Up
4 4 5 1
5 5 6 1
6 6 1 1 #Down
7 4 7 1
8 7 8 1
9 8 9 1
10 9 10 1
11 5 10 1
12 9 11 1 #Down
13 11 12 1
14 12 13 1
15 13 14 1
16 14 15 1
17 15 16 1
18 16 17 2
19 17 18 1
20 18 19 2
21 19 20 1
22 20 21 2
23 21 22 1
24 22 23 1
25 23 24 1
26 24 25 1
27 12 26 1 #Up
28 22 27 2
29 24 28 1
30 28 29 2
31 28 30 1
32 25 31 1
33 31 32 1
34 32 33 1
35 33 34 1
36 34 35 1
37 34 36 2
38 6 37 1
39 37 38 1
40 38 39 1
41 38 40 2
42 39 41 1 #Down
43 39 42 1
44 42 43 1
45 43 44 1
46 44 45 1
47 45 46 1
48 46 47 1
49 42 47 1
50 42 48 1 #Down
51 48 49 1
52 44 50 1 #Up
53 45 51 1 #Up
54 46 52 2
55 8 53 1
56 7 54 1 #Down
57 54 55 1
58 8 56 1
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