| Entry |
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| Name |
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| Formula |
C54H76N8O15
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| Exact mass |
1076.543
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| Mol weight |
1077.2258
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| Structure |
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| Sequence |
0 Hpl 1 Gln 2 Thr 3 Tyr 4 Ahp 5 Leu 6 Tyr 7 Ile
(Cyclization: 2-7) |
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| Organism |
Microcystis aeruginosa |
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| Type |
NRP |
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| Comment |
3 Tyr is modified by tetrahydro. (i.e. tetrahydrotyrosine, ThTyr)
6 Tyr is modified by N-methyl. (i.e. N-Methyltyrosine, MeTyr)
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| Other DBs |
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| LinkDB |
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| KCF data |
ATOM 77
1 C1y C 49.6300 -22.9600
2 C5x C 49.6300 -24.3600
3 N1y N 50.7500 -25.0600
4 C1y C 52.0100 -24.3600
5 C1x C 52.0100 -22.9600
6 C1x C 50.7500 -22.2600
7 O5x O 48.4400 -25.0600
8 C1y C 50.7500 -26.4600
9 C5x C 49.6300 -27.1600
10 C1b C 51.9400 -27.1600
11 O1a O 53.2000 -25.0600
12 N1y N 49.6300 -28.5600
13 O5x O 48.4400 -26.4600
14 C1y C 48.4400 -29.2600
15 C1a C 50.7500 -29.2600
16 C5x C 47.2500 -28.5600
17 C1b C 48.4400 -30.5900
18 C8y C 49.6300 -31.2900
19 N1x N 46.0600 -29.2600
20 O5x O 47.2500 -27.1600
21 C1y C 44.8700 -28.5600
22 C7x C 44.8700 -27.1600
23 N1x N 48.4400 -22.2600
24 C5x C 47.2500 -22.9600
25 C1y C 46.0600 -22.2600
26 O5x O 47.2500 -24.3600
27 N1x N 44.8700 -22.9600
28 C1b C 46.0600 -20.8600
29 C5x C 43.6800 -22.2600
30 C1y C 42.4900 -22.9600
31 O5x O 43.6800 -20.8600
32 C1y C 42.4900 -24.3600
33 C1c C 43.6800 -29.2600
34 C1a C 42.4900 -28.5600
35 C1b C 43.6800 -30.5900
36 C1a C 42.4900 -31.2900
37 O6a O 46.0600 -26.4600
38 C8x C 49.6300 -32.6200
39 C8x C 50.8200 -33.3200
40 C8y C 52.0100 -32.6200
41 C8x C 52.0100 -31.2900
42 C8x C 50.8200 -30.5900
43 C1y C 47.2500 -20.1600
44 C1x C 48.4400 -20.8600
45 C1x C 49.7000 -20.1600
46 C1y C 49.7000 -18.7600
47 C2x C 48.5100 -18.0600
48 C2x C 47.2500 -18.7600
49 O7x O 43.6800 -25.0600
50 O1a O 50.8200 -18.0600
51 C1a C 41.3000 -25.0600
52 N1b N 41.3000 -22.2600
53 C5a C 40.1100 -22.9600
54 C1c C 38.8500 -22.2600
55 N1b N 37.6600 -22.9600
56 O5a O 40.1100 -24.3600
57 C1b C 38.8500 -20.8600
58 C1b C 37.6600 -20.1600
59 C5a C 37.6600 -18.7600
60 N1a N 36.4700 -18.0600
61 O5a O 38.8500 -18.0600
62 C5a C 36.4700 -22.2600
63 C1c C 35.2800 -22.9600
64 O5a O 36.4700 -20.8600
65 O1a O 35.2800 -24.3600
66 O1a O 53.2700 -33.3200
67 C1c C 53.3400 -27.1600
68 C1a C 54.0400 -28.3500
69 C1a C 54.0400 -25.9000
70 C1b C 34.0900 -22.2600
71 C8y C 32.9000 -22.9600
72 C8x C 31.7100 -22.2600
73 C8x C 30.4500 -22.9600
74 C8y C 30.4500 -24.3600
75 C8x C 31.6400 -25.0600
76 C8x C 32.9000 -24.3600
77 O1a O 29.2600 -25.0600
BOND 81
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 1 6 1
7 2 7 2
8 3 8 1
9 8 9 1
10 8 10 1
11 4 11 1
12 9 12 1
13 9 13 2
14 12 14 1
15 12 15 1
16 14 16 1
17 14 17 1
18 17 18 1
19 16 19 1
20 16 20 2
21 19 21 1
22 21 22 1
23 1 23 1
24 23 24 1
25 24 25 1
26 24 26 2
27 25 27 1
28 25 28 1
29 27 29 1
30 29 30 1
31 29 31 2
32 30 32 1
33 21 33 1
34 33 34 1
35 33 35 1
36 35 36 1
37 22 37 2
38 18 38 2
39 38 39 1
40 39 40 2
41 40 41 1
42 41 42 2
43 18 42 1
44 28 43 1
45 43 44 1
46 44 45 1
47 45 46 1
48 46 47 1
49 47 48 2
50 43 48 1
51 32 49 1
52 46 50 1
53 49 22 1
54 32 51 1
55 30 52 1
56 52 53 1
57 53 54 1
58 54 55 1
59 53 56 2
60 54 57 1
61 57 58 1
62 58 59 1
63 59 60 1
64 59 61 2
65 55 62 1
66 62 63 1
67 62 64 2
68 63 65 1
69 40 66 1
70 10 67 1
71 67 68 1
72 67 69 1
73 63 70 1
74 70 71 1
75 71 72 2
76 72 73 1
77 73 74 2
78 74 75 1
79 75 76 2
80 71 76 1
81 74 77 1
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