Conotoxin analogue [D-Ala2]BuIIIB
ID | Type | Value order | Atom ID 1 | Atom ID 2 |
---|---|---|---|---|
1 | disulfide | sing | 1:CYS5:SG | 1:CYS17:SG |
2 | disulfide | sing | 1:CYS6:SG | 1:CYS23:SG |
3 | disulfide | sing | 1:CYS13:SG | 1:CYS24:SG |
Polymer type: polypeptide(L)
Total | 1H | 13C | 15N | |
---|---|---|---|---|
All | 90.5 % (238 of 263) | 99.3 % (141 of 142) | 75.8 % (72 of 95) | 96.2 % (25 of 26) |
Backbone | 82.6 % (119 of 144) | 98.0 % (50 of 51) | 66.7 % (46 of 69) | 95.8 % (23 of 24) |
Sidechain | 100.0 % (140 of 140) | 100.0 % (91 of 91) | 100.0 % (47 of 47) | 100.0 % (2 of 2) |
Aromatic | 100.0 % (16 of 16) | 100.0 % (8 of 8) | 100.0 % (7 of 7) | 100.0 % (1 of 1) |
Methyl | 100.0 % (6 of 6) | 100.0 % (3 of 3) | 100.0 % (3 of 3) |
1. [D-Ala2]BuIIIB
VAERCCKNGK RGCGRWCRDH SRCCSolvent system 95% H2O/5% D2O, Pressure 1 atm, Temperature 273 K, pH 5.5
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | [D-Ala2]BuIIIB | natural abundance | 1.2 mM | |
2 | H2O | natural abundance | 95 % | |
3 | D2O | natural abundance | 5 % |