Structural studies about ScnTx neurotoxin using Solution NMR 2D and 3D
ID | Type | Value order | Atom ID 1 | Atom ID 2 |
---|---|---|---|---|
1 | disulfide | sing | 1:CYS19:SG | 1:CYS38:SG |
2 | disulfide | sing | 1:CYS33:SG | 1:CYS55:SG |
3 | disulfide | sing | 1:CYS57:SG | 1:CYS68:SG |
4 | disulfide | sing | 1:CYS69:SG | 1:CYS74:SG |
Polymer type: polypeptide(L)
Total | 1H | 13C | 15N | |
---|---|---|---|---|
All | 76.6 % (669 of 873) | 86.3 % (397 of 460) | 63.1 % (207 of 328) | 76.5 % (65 of 85) |
Backbone | 89.3 % (400 of 448) | 90.3 % (140 of 155) | 88.2 % (195 of 221) | 90.3 % (65 of 72) |
Sidechain | 65.6 % (324 of 494) | 81.6 % (249 of 305) | 42.6 % (75 of 176) | 0.0 % (0 of 13) |
Aromatic | 23.3 % (14 of 60) | 46.7 % (14 of 30) | 0.0 % (0 of 29) | 0.0 % (0 of 1) |
Methyl | 54.8 % (23 of 42) | 95.2 % (20 of 21) | 14.3 % (3 of 21) |
1. entity 1
MRGSHHHHHH GSIEGRMICY NQQSSQPPTT KTCSETSCYK KTWRDHRGTI IERGCGCPKV KPGIKLHCCR TDKCNNSolvent system 95% H2O/5% D2O, Pressure 1 atm, Temperature 298 K, pH 6.8, Details 1 mM SCNTX NEUROTOXIN, 95% H2O/5% D2O
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | SCNTX NEUROTOXIN | natural abundance | 1 mM |
Solvent system 95% H2O/5% D2O, Pressure 1 atm, Temperature 298 K, pH 6.8, Details 0.7 mM [U-100% 13C; U-100% 15N, 1H] SCNTX NEUROTOXIN, 95% H2O/5% D2O
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
2 | SCNTX NEUROTOXIN | [U-100% 13C; U-100% 15N, 1H] | 0.7 mM |