Entry |
|
Name |
|
Formula |
C40H54N8O9
|
Exact mass |
790.4014
|
Mol weight |
790.905
|
Structure |
|
Sequence |
0 Tyr 1 Gly 2 Gln 3 Ile 4 Ser 5 Pro 6 Phe (Cyclization: 0-6) |
Gene |
|
Organism |
Nostoc sp. ATCC 53789 |
Type |
NRP |
Comment |
5 Pro is modified by 4-methyl. (i.e. 4-Mehtylproline, MePro)
|
Other DBs |
|
LinkDB |
|
KCF data |
ATOM 57
1 C1y C 36.8900 -25.3400
2 N1y N 36.8900 -26.7400
3 C5a C 38.0800 -27.4400
4 O5a O 39.2700 -26.7400
5 O5a O 39.2700 -25.3400
6 C5a C 38.0800 -24.7100
7 C1c C 38.0800 -28.8400
8 N1b N 39.2700 -29.5400
9 C5a C 40.4600 -28.8400
10 O5a O 40.4600 -27.4400
11 C1c C 41.6500 -29.5400
12 N1b N 42.8400 -28.8400
13 C5a C 44.0300 -29.5400
14 C1c C 45.2900 -28.8400
15 N1b N 45.2900 -27.4400
16 C5a C 46.4800 -26.7400
17 C1b C 46.4800 -25.3400
18 N1b N 45.2900 -24.7100
19 C5a C 45.2900 -23.3100
20 C1c C 44.0300 -22.6100
21 N2b N 42.8400 -23.3100
22 C1c C 39.2700 -22.6100
23 N1b N 38.0800 -23.3100
24 C2b C 40.6700 -22.6100
25 C1c C 41.6500 -30.9400
26 C1a C 40.4600 -31.6400
27 C1b C 42.8400 -31.5700
28 C1a C 42.8400 -32.9700
29 O5a O 44.0300 -30.9400
30 C1b C 46.4800 -29.5400
31 C1b C 47.6000 -28.8400
32 C5a C 48.7900 -29.5400
33 N1a N 49.9800 -28.8400
34 O5a O 48.7900 -30.9400
35 O5a O 47.6700 -27.4400
36 O5a O 46.4800 -22.6100
37 C1b C 44.0300 -21.2100
38 C8y C 45.2900 -20.5100
39 C8x C 46.4800 -21.2100
40 C8x C 47.6700 -20.5100
41 C8y C 47.6700 -19.1100
42 C8x C 46.4800 -18.4100
43 C8x C 45.2900 -19.1100
44 O1a O 48.8600 -18.4100
45 C1b C 38.9200 -21.2800
46 C8y C 37.5200 -20.9300
47 C1b C 36.8200 -29.5400
48 O1a O 35.6300 -28.8400
49 C1x C 35.5600 -24.9200
50 C1y C 34.7200 -26.0400
51 C1x C 35.5600 -27.1600
52 C1a C 33.3200 -26.0400
53 C8x C 37.1350 -19.5840
54 C8x C 35.7768 -19.2444
55 C8x C 34.8036 -20.2509
56 C8x C 35.1886 -21.5969
57 C8x C 36.5468 -21.9365
BOND 60
1 1 2 1
2 2 3 1
3 3 4 2
4 5 6 2
5 1 6 1
6 3 7 1
7 7 8 1
8 8 9 1
9 9 10 2
10 9 11 1
11 11 12 1
12 12 13 1
13 13 14 1
14 14 15 1
15 15 16 1
16 16 17 1
17 17 18 1
18 18 19 1
19 19 20 1
20 20 21 1
21 22 23 1
22 6 23 1
23 22 24 1
24 24 21 2
25 11 25 1
26 25 26 1 #Down
27 25 27 1
28 27 28 1
29 13 29 2
30 14 30 1 #Down
31 30 31 1
32 31 32 1
33 32 33 1
34 32 34 2
35 16 35 2
36 19 36 2
37 20 37 1 #Up
38 37 38 1
39 38 39 2
40 39 40 1
41 40 41 2
42 41 42 1
43 42 43 2
44 38 43 1
45 41 44 1
46 22 45 1 #Up
47 45 46 1
48 7 47 1 #Up
49 47 48 1
50 1 49 1
51 49 50 1
52 50 51 1
53 2 51 1
54 50 52 1 #Up
55 46 53 2
56 53 54 1
57 54 55 2
58 55 56 1
59 56 57 2
60 46 57 1
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