Solution structure of the SH2 domain of Csk in complex with a phosphopeptide from Cbp
GPLGSMPWFH GKITREQAER LLYPPETGLF LVRESTNYPG DYTLCVSCEG KVEHYRIMYH ASKLSIDEEV YFENLMQLVE HYTTDADGLC TRLIKPKVM
ID | Type | Value order | Atom ID 1 | Atom ID 2 |
---|---|---|---|---|
1 | disulfide | sing | 1:CYS48:SG | 1:CYS90:SG |
Polymer type: polypeptide(L)
Total | 1H | 13C | 15N | |
---|---|---|---|---|
All | 92.3 % (1466 of 1588) | 90.8 % (753 of 829) | 92.8 % (581 of 626) | 99.2 % (132 of 133) |
Backbone | 97.1 % (775 of 798) | 96.7 % (264 of 273) | 96.7 % (385 of 398) | 99.2 % (126 of 127) |
Sidechain | 89.1 % (816 of 916) | 87.9 % (489 of 556) | 90.7 % (321 of 354) | 100.0 % (6 of 6) |
Aromatic | 62.9 % (83 of 132) | 65.2 % (43 of 66) | 60.0 % (39 of 65) | 100.0 % (1 of 1) |
Methyl | 100.0 % (130 of 130) | 100.0 % (65 of 65) | 100.0 % (65 of 65) |
1. Csk SH2
GPLGSMPWFH GKITREQAER LLYPPETGLF LVRESTNYPG DYTLCVSCEG KVEHYRIMYH ASKLSIDEEV YFENLMQLVE HYTTDADGLC TRLIKPKVM2. Cbp phosphopeptide
GPLGSKRFSS LSYKSREEDP TLTEEEISAM XSSVNKPGSolvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 6.0
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | Csk SH2 domain | [U-13C; U-15N] | protein | 0.5 ~ 1.0 mM |
2 | sodium phosphate | natural abundance | 20 mM | |
3 | sodium chloride | natural abundance | 50 mM | |
4 | Cbp phosphopeptide | natural abundance | protein | 0.5 ~ 1.0 mM |
5 | H2O | natural abundance | solvent | 90 % |
6 | D2O | [U-99% 2H] | solvent | 10 % |
Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 6.0
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
7 | Csk SH2 domain | [U-15N] | protein | 0.5 ~ 1.0 mM |
8 | sodium phosphate | natural abundance | 20 mM | |
9 | sodium chloride | natural abundance | 50 mM | |
10 | Cbp phosphopeptide | natural abundance | protein | 0.5 ~ 1.0 mM |
11 | H2O | natural abundance | 90 % | |
12 | D2O | [U-99% 2H] | 10 % |
Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 6.0
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
13 | Cbp phosphopeptide | [U-13C; U-15N] | protein | 0.5 ~ 1.0 mM |
14 | sodium phosphate | natural abundance | 20 mM | |
15 | sodium chloride | natural abundance | 50 mM | |
16 | Csk SH2 domain | natural abundance | protein | 0.5 ~ 1.0 mM |
17 | H2O | natural abundance | 90 % | |
18 | D2O | [U-99% 2H] | 10 % |
Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 6.0
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
19 | Cbp phosphopeptide | [U-15N] | protein | 0.5 ~ 1.0 mM |
20 | sodium phosphate | natural abundance | 20 mM | |
21 | sodium chloride | natural abundance | 50 mM | |
22 | Csk SH2 domain | natural abundance | protein | 0.5 ~ 1.0 mM |
23 | H2O | natural abundance | 90 % | |
24 | D2O | [U-99% 2H] | 10 % |
Solvent system 100% D2O, Pressure 1 atm, Temperature 298 K, pH 6.0
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
25 | Csk SH2 domain | [U-13C; U-15N] | protein | 0.5 ~ 1.0 mM |
26 | sodium phosphate | natural abundance | 20 mM | |
27 | sodium chloride | natural abundance | 50 mM | |
28 | Cbp phosphopeptide | natural abundance | protein | 0.5 ~ 1.0 mM |
29 | D2O | [U-99% 2H] | 100 % |
Solvent system 100% D2O, Pressure 1 atm, Temperature 298 K, pH 6.0
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
30 | Cbp phosphopeptide | [U-13C; U-15N] | protein | 0.5 ~ 1.0 mM |
31 | sodium phosphate | natural abundance | 20 mM | |
32 | sodium chloride | natural abundance | 50 mM | |
33 | Csk SH2 domain | natural abundance | protein | 0.5 ~ 1.0 mM |
34 | D2O | [U-2H] | 100 % |