Backbone and sidechain 1H, 13C, and 15N Chemical Shift assignments for nanobody Nb23
QVQLQESGGG LVQAGGSLRL SCAASGRTFS SYAMAWFRQA PGKEREFVAR ISGVGTNTYY TDSVKGRVTI SRDNAKNTVY LQMNSLKPED TAVYYCAASI YGYYSDTSYY TRLNNYLYWG QGTQVTVSS
ID | Type | Value order | Atom ID 1 | Atom ID 2 |
---|---|---|---|---|
1 | disulfide | sing | 1:CYS22:SG | 1:CYS96:SG |
Polymer type: polypeptide(L)
Total | 1H | 13C | 15N | |
---|---|---|---|---|
All | 83.2 % (1211 of 1456) | 85.3 % (633 of 742) | 81.0 % (456 of 563) | 80.8 % (122 of 151) |
Backbone | 95.7 % (737 of 770) | 95.5 % (257 of 269) | 95.7 % (358 of 374) | 96.1 % (122 of 127) |
Sidechain | 73.3 % (588 of 802) | 79.5 % (376 of 473) | 69.5 % (212 of 305) | 0.0 % (0 of 24) |
Aromatic | 49.4 % (78 of 158) | 68.4 % (54 of 79) | 31.2 % (24 of 77) | 0.0 % (0 of 2) |
Methyl | 88.3 % (113 of 128) | 95.3 % (61 of 64) | 81.3 % (52 of 64) |
1. entity 1
QVQLQESGGG LVQAGGSLRL SCAASGRTFS SYAMAWFRQA PGKEREFVAR ISGVGTNTYY TDSVKGRVTI SRDNAKNTVY LQMNSLKPED TAVYYCAASI YGYYSDTSYY TRLNNYLYWG QGTQVTVSSSolvent system 95% H2O/5% D2O, Pressure 1 atm, Temperature 298 K, pH 6.95
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | Nb23 monomer | [U-100% 13C; U-100% 15N] | 250 uM | |
2 | sodium phosphate | natural abundance | 10 mM | |
3 | D2O | natural abundance | 5 % | |
4 | TRIS | natural abundance | 19.5 mM | |
5 | sodium chloride | natural abundance | 21 mM |
Solvent system 95% H2O/5% D2O, Pressure 1 atm, Temperature 298 K, pH 6.95
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
6 | Nb23 monomer | [U-100% 13C; U-100% 15N] | 290 uM | |
7 | sodium phosphate | natural abundance | 10 mM | |
8 | D2O | natural abundance | 5 % |
Solvent system 95% H2O/5% D2O, Pressure 1 atm, Temperature 298 K, pH 6.95
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
9 | Nb23 monomer | natural abundance | 190 uM | |
10 | sodium phosphate | natural abundance | 10 mM | |
11 | D2O | natural abundance | 5 % | |
12 | sodium chloride | natural abundance | 6.3 mM |
Solvent system 100% D2O, Pressure 1 atm, Temperature 298 K, pH 6.95
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
13 | Nb23 monomer | natural abundance | 100 uM | |
14 | sodium phosphate | natural abundance | 10 mM | |
15 | D2O | natural abundance | 100 % | |
16 | sodium chloride | natural abundance | 20 mM |
Solvent system 100% D2O, Pressure 1 atm, Temperature 298 K, pH 6.95
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
17 | Nb23 monomer | [U-100% 13C; U-100% 15N] | 175 uM | |
18 | sodium phosphate | natural abundance | 10 mM | |
19 | D2O | natural abundance | 100 % |