MAUROCALCINE IN D CONFIGURATION FROM SCORPIO MAURUS PALMATUS
ID | Type | Value order | Atom ID 1 | Atom ID 2 |
---|---|---|---|---|
1 | disulfide | sing | 1:CYS3:SG | 1:CYS17:SG |
2 | disulfide | sing | 1:CYS10:SG | 1:CYS21:SG |
3 | disulfide | sing | 1:CYS16:SG | 1:CYS32:SG |
Polymer type: polypeptide(D)
Total | 1H | |
---|---|---|
All | 98.2 % (213 of 217) | 98.2 % (213 of 217) |
Backbone | 95.5 % (64 of 67) | 95.5 % (64 of 67) |
Sidechain | 99.3 % (149 of 150) | 99.3 % (149 of 150) |
Aromatic | 100.0 % (2 of 2) | 100.0 % (2 of 2) |
Methyl | 100.0 % (9 of 9) | 100.0 % (9 of 9) |
1. D-MAUROCALCINE
GDCLPHLKLC KENKDCCSKK CKRRGTNIEK RCRSolvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 300 K, pH 7
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | D-MAUROCALCINE | natural abundance | 4 mg | |
2 | H2O | natural abundance | 90 % | |
3 | D2O | natural abundance | 10 % |
Solvent system 100% D2O, Pressure 1 atm, Temperature 300 K, pH 7
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
4 | D-MAUROCALCINE | natural abundance | 4 mg | |
5 | D2O | natural abundance | 100 % |