Highly disulfide-constrained antifeedant jasmintides from Jasminum sambac flowers
ID | Type | Value order | Atom ID 1 | Atom ID 2 |
---|---|---|---|---|
1 | disulfide | sing | 1:CYS3:SG | 1:CYS24:SG |
2 | disulfide | sing | 1:CYS6:SG | 1:CYS20:SG |
3 | disulfide | sing | 1:CYS12:SG | 1:CYS25:SG |
Polymer type: polypeptide(L)
Total | 1H | |
---|---|---|
All | 96.3 % (156 of 162) | 96.3 % (156 of 162) |
Backbone | 100.0 % (57 of 57) | 100.0 % (57 of 57) |
Sidechain | 94.3 % (99 of 105) | 94.3 % (99 of 105) |
Aromatic | 90.0 % (9 of 10) | 90.0 % (9 of 10) |
Methyl | 93.8 % (15 of 16) | 93.8 % (15 of 16) |
1. entity 1
QLCLLCQTSR DCNYIIWTVC RDGCCNISSolvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 7, Details 0.7 mM Not labled jasmintide js3, 90% H2O/10% D2O
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | jasmintide js3 | natural abundance | 0.7 mM | |
2 | H2O | natural abundance | solvent | 90 % |
3 | D2O | [U-2H] | solvent | 10 % |
Solvent system 100% D2O, Pressure 1 atm, Temperature 298 K, pH 7, Details 0.7 mM Not labeled jasmintide js3, 100% D2O
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
4 | jasmintide js3 | natural abundance | 0.7 mM | |
5 | D2O | [U-2H] | solvent | 100 % |