Entry |
|
Name |
|
Formula |
C43H65N5O9S
|
Exact mass |
827.4503
|
Mol weight |
828.0693
|
Structure |
|
Sequence |
0 Pip 1 Ile 2 Val 3 Mao 4 Cys 5 Phe 6 Mtn |
Gene |
|
Organism |
Angiococcus disciformis |
Type |
PKNRP |
Comment |
0 Pip is modified by N-methyl. (i.e. N-Methyl-L-pipecolic acid)
|
Other DBs |
|
LinkDB |
|
KCF data |
ATOM 58
1 C1x C 12.9500 -20.7200
2 C1x C 12.9500 -22.1200
3 N1y N 14.1400 -22.8200
4 C1y C 15.4000 -22.1200
5 C1x C 15.4000 -20.7200
6 C1x C 14.1400 -20.0200
7 C5a C 16.5900 -22.8200
8 N1b N 17.8500 -22.1200
9 C1c C 19.0400 -22.8200
10 C5a C 20.2300 -22.1200
11 N1c N 21.4900 -22.8200
12 C1c C 22.6800 -22.1200
13 C1b C 23.9400 -22.8200
14 C1c C 25.2000 -22.1200
15 C8y C 26.3900 -22.8200
16 O5a O 16.5900 -24.2200
17 C1a C 14.1400 -24.2200
18 C1c C 19.0400 -24.2200
19 C1a C 20.2300 -24.9200
20 C1b C 17.8500 -24.9200
21 C1a C 17.8500 -26.3200
22 O5a O 20.2300 -20.7200
23 C1b C 21.4900 -24.2200
24 O7a O 22.6800 -24.9200
25 C7a C 22.6800 -26.3200
26 O6a O 21.4900 -27.0200
27 C1b C 23.9400 -27.0200
28 C1c C 23.9400 -28.4900
29 C1a C 22.6800 -29.1900
30 C1a C 25.1300 -29.1900
31 C1c C 22.6800 -20.7200
32 C1a C 23.9400 -20.0200
33 C1a C 21.4900 -20.0200
34 O7a O 25.2000 -20.7200
35 C7a C 26.3900 -20.0200
36 C1a C 27.5800 -20.7200
37 O6a O 26.3900 -18.6200
38 S2x S 26.8100 -24.1500
39 C8x C 28.2100 -24.1500
40 C8y C 28.6300 -22.8200
41 N5x N 27.5100 -21.9800
42 C5a C 29.8200 -22.1200
43 N1b N 31.0800 -22.8200
44 C1c C 32.2700 -22.1200
45 C1b C 33.4600 -22.8200
46 O5a O 29.8200 -20.7200
47 C1b C 32.2700 -20.7200
48 C8y C 33.4600 -20.0200
49 C8x C 34.6500 -20.7200
50 C8x C 35.9100 -20.0200
51 C8x C 35.9100 -18.6200
52 C8x C 34.7200 -17.9200
53 C8x C 33.4600 -18.6200
54 C1c C 33.4600 -24.2200
55 C6a C 34.6500 -24.9200
56 C1a C 32.2700 -24.9200
57 O6a O 34.6500 -26.3200
58 O6a O 35.8400 -24.2200
BOND 60
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 4 7 1
8 7 8 1
9 8 9 1
10 9 10 1
11 10 11 1
12 11 12 1
13 12 13 1
14 13 14 1
15 14 15 1
16 7 16 2
17 3 17 1
18 9 18 1
19 18 19 1 #Up
20 18 20 1
21 20 21 1
22 10 22 2
23 11 23 1
24 23 24 1
25 24 25 1
26 25 26 2
27 25 27 1
28 27 28 1
29 28 29 1
30 28 30 1
31 12 31 1 #Up
32 31 32 1
33 31 33 1
34 14 34 1 #Up
35 34 35 1
36 35 36 1
37 35 37 2
38 38 39 1
39 39 40 2
40 40 41 1
41 41 15 2
42 38 15 1
43 40 42 1
44 42 43 1
45 43 44 1
46 44 45 1
47 42 46 2
48 44 47 1 #Up
49 47 48 1
50 48 49 2
51 49 50 1
52 50 51 2
53 51 52 1
54 52 53 2
55 48 53 1
56 45 54 1
57 54 55 1
58 54 56 1 #Up
59 55 57 1
60 55 58 2
|