Solution NMR Structure of the uncharacterized protein from gene locus VNG_0733H of Halobacterium salinarium, Northeast Structural Genomics Consortium Target HsR50.
MSPIPLPVTD TDDAWRARIA AHRADKDEFL ATHDQSPIPP ADRGAFDGLR YFDIDASFRV AARYQPARDP EAVELETTRG PPAEYTRAAV LGFDLGDSHH TLTAFRVEGE SSLFVPFTDE TTDDGRTYEH GRYLDVDPAG ADGGDEVALD FNLAYNPFCA YGGSFSCALP PADNHVPAAI TAGERVDADL E
Polymer type: polypeptide(L)
Total | 1H | 13C | 15N | |
---|---|---|---|---|
All | 83.7 % (1722 of 2058) | 79.8 % (840 of 1052) | 86.1 % (710 of 825) | 95.0 % (172 of 181) |
Backbone | 94.6 % (1054 of 1114) | 93.9 % (357 of 380) | 94.6 % (529 of 559) | 96.0 % (168 of 175) |
Sidechain | 74.2 % (832 of 1121) | 71.0 % (477 of 672) | 79.2 % (351 of 443) | 66.7 % (4 of 6) |
Aromatic | 63.4 % (128 of 202) | 68.3 % (69 of 101) | 58.0 % (58 of 100) | 100.0 % (1 of 1) |
Methyl | 100.0 % (194 of 194) | 100.0 % (97 of 97) | 100.0 % (97 of 97) |
1. HsR50
MSPIPLPVTD TDDAWRARIA AHRADKDEFL ATHDQSPIPP ADRGAFDGLR YFDIDASFRV AARYQPARDP EAVELETTRG PPAEYTRAAV LGFDLGDSHH TLTAFRVEGE SSLFVPFTDE TTDDGRTYEH GRYLDVDPAG ADGGDEVALD FNLAYNPFCA YGGSFSCALP PADNHVPAAI TAGERVDADL ESolvent system 95% H2O/5% D2O, Pressure 1 atm, Temperature 298 K, pH 6.5, Details 0.726 mM hsr50.005, 90% H2O/10% D2O
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | hsr50.005 | [U-100% 13C; U-100% 15N] | 0.726 mM | |
2 | Proteinase Inhibitors | natural abundance | 1 na | |
3 | NaN3 | natural abundance | 0.02 % | |
4 | DTT | natural abundance | 10 mM | |
5 | CaCL2 | natural abundance | 5 mM | |
6 | NaCL | natural abundance | 200 mM | |
7 | MES pH 6.5 | natural abundance | 20 mM | |
8 | D2O | natural abundance | 10 % | |
9 | DSS | natural abundance | 50 uM |
Solvent system 95% H2O/5% D2O, Pressure 1 atm, Temperature 298 K, pH 6.5, Details 0.726 mM hsr50.005, 95% H2O/5% D2O
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
10 | hsr50.009 | [U-100% 13C; U-100% 15N; U-2H] | 0.800 mM | |
11 | Proteinase Inhibitors | natural abundance | 1 na | |
12 | NaN3 | natural abundance | 0.02 % | |
13 | DTT | natural abundance | 10 mM | |
14 | CaCL2 | natural abundance | 5 mM | |
15 | NaCL | natural abundance | 200 mM | |
16 | MES pH 6.5 | natural abundance | 20 mM | |
17 | D2O | natural abundance | 10 % | |
18 | DSS | natural abundance | 50 uM |
Solvent system 95% H2O/5% D2O, Pressure 1 atm, Temperature 298 K, pH 6.5, Details 0.726 mM hsr50.005, 90% H2O/10% D2O
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
19 | hsr50.007 | [U-100% 13C; U-100% 15N] | 0.674 mM | |
20 | Proteinase Inhibitors | natural abundance | 1 na | |
21 | NaN3 | natural abundance | 0.02 % | |
22 | DTT | natural abundance | 10 mM | |
23 | CaCL2 | natural abundance | 5 mM | |
24 | NaCL | natural abundance | 200 mM | |
25 | MES pH 6.5 | natural abundance | 20 mM | |
26 | D2O | natural abundance | 10 % | |
27 | DSS | natural abundance | 50 uM |
Atom type | Mol. common name | Atom group | Value | Ref. method | Ref. type | Shift ratio |
---|---|---|---|---|---|---|
13C | DSS | methyl protons | 0.0 ppm | na | indirect | 0.2514495 |
1H | DSS | methyl protons | 0.0 ppm | internal | direct | 1.0 |
15N | DSS | methyl protons | 0.0 ppm | na | indirect | 0.1013291 |
Atom type | Mol. common name | Atom group | Value | Ref. method | Ref. type | Shift ratio |
---|---|---|---|---|---|---|
13C | DSS | methyl protons | 0.0 ppm | na | indirect | 0.2514495 |
1H | DSS | methyl protons | 0.0 ppm | internal | direct | 1.0 |
15N | DSS | methyl protons | 0.0 ppm | na | indirect | 0.1013291 |
Atom type | Mol. common name | Atom group | Value | Ref. method | Ref. type | Shift ratio |
---|---|---|---|---|---|---|
13C | DSS | methyl protons | 0.0 ppm | na | indirect | 0.2514495 |
1H | DSS | methyl protons | 0.0 ppm | internal | direct | 1.0 |
15N | DSS | methyl protons | 0.0 ppm | na | indirect | 0.1013291 |
Atom type | Mol. common name | Atom group | Value | Ref. method | Ref. type | Shift ratio |
---|---|---|---|---|---|---|
13C | DSS | methyl protons | 0.0 ppm | na | indirect | 0.2514495 |
1H | DSS | methyl protons | 0.0 ppm | internal | direct | 1.0 |
15N | DSS | methyl protons | 0.0 ppm | na | indirect | 0.1013291 |
Bruker Avance - 800 MHz
State isotropic, Solvent system 95% H2O/5% D2O, Pressure 1 atm, Temperature 298 K, pH 6.5, Details 0.726 mM hsr50.005, 90% H2O/10% D2O
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | hsr50.005 | [U-100% 13C; U-100% 15N] | 0.726 mM | |
2 | Proteinase Inhibitors | natural abundance | 1 na | |
3 | NaN3 | natural abundance | 0.02 % | |
4 | DTT | natural abundance | 10 mM | |
5 | CaCL2 | natural abundance | 5 mM | |
6 | NaCL | natural abundance | 200 mM | |
7 | MES pH 6.5 | natural abundance | 20 mM | |
8 | D2O | natural abundance | 10 % | |
9 | DSS | natural abundance | 50 uM |
Bruker Avance - 800 MHz
State isotropic, Solvent system 95% H2O/5% D2O, Pressure 1 atm, Temperature 298 K, pH 6.5, Details 0.726 mM hsr50.005, 90% H2O/10% D2O
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | hsr50.005 | [U-100% 13C; U-100% 15N] | 0.726 mM | |
2 | Proteinase Inhibitors | natural abundance | 1 na | |
3 | NaN3 | natural abundance | 0.02 % | |
4 | DTT | natural abundance | 10 mM | |
5 | CaCL2 | natural abundance | 5 mM | |
6 | NaCL | natural abundance | 200 mM | |
7 | MES pH 6.5 | natural abundance | 20 mM | |
8 | D2O | natural abundance | 10 % | |
9 | DSS | natural abundance | 50 uM |
Bruker Avance - 800 MHz
State isotropic, Solvent system 95% H2O/5% D2O, Pressure 1 atm, Temperature 298 K, pH 6.5, Details 0.726 mM hsr50.005, 90% H2O/10% D2O
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | hsr50.005 | [U-100% 13C; U-100% 15N] | 0.726 mM | |
2 | Proteinase Inhibitors | natural abundance | 1 na | |
3 | NaN3 | natural abundance | 0.02 % | |
4 | DTT | natural abundance | 10 mM | |
5 | CaCL2 | natural abundance | 5 mM | |
6 | NaCL | natural abundance | 200 mM | |
7 | MES pH 6.5 | natural abundance | 20 mM | |
8 | D2O | natural abundance | 10 % | |
9 | DSS | natural abundance | 50 uM |
Bruker Avance - 800 MHz
State isotropic, Solvent system 95% H2O/5% D2O, Pressure 1 atm, Temperature 298 K, pH 6.5, Details 0.726 mM hsr50.005, 90% H2O/10% D2O
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | hsr50.005 | [U-100% 13C; U-100% 15N] | 0.726 mM | |
2 | Proteinase Inhibitors | natural abundance | 1 na | |
3 | NaN3 | natural abundance | 0.02 % | |
4 | DTT | natural abundance | 10 mM | |
5 | CaCL2 | natural abundance | 5 mM | |
6 | NaCL | natural abundance | 200 mM | |
7 | MES pH 6.5 | natural abundance | 20 mM | |
8 | D2O | natural abundance | 10 % | |
9 | DSS | natural abundance | 50 uM |
Bruker Avance - 800 MHz
State isotropic, Solvent system 95% H2O/5% D2O, Pressure 1 atm, Temperature 298 K, pH 6.5, Details 0.726 mM hsr50.005, 90% H2O/10% D2O
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | hsr50.005 | [U-100% 13C; U-100% 15N] | 0.726 mM | |
2 | Proteinase Inhibitors | natural abundance | 1 na | |
3 | NaN3 | natural abundance | 0.02 % | |
4 | DTT | natural abundance | 10 mM | |
5 | CaCL2 | natural abundance | 5 mM | |
6 | NaCL | natural abundance | 200 mM | |
7 | MES pH 6.5 | natural abundance | 20 mM | |
8 | D2O | natural abundance | 10 % | |
9 | DSS | natural abundance | 50 uM |
Bruker Avance - 800 MHz
State isotropic, Solvent system 95% H2O/5% D2O, Pressure 1 atm, Temperature 298 K, pH 6.5, Details 0.726 mM hsr50.005, 90% H2O/10% D2O
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | hsr50.005 | [U-100% 13C; U-100% 15N] | 0.726 mM | |
2 | Proteinase Inhibitors | natural abundance | 1 na | |
3 | NaN3 | natural abundance | 0.02 % | |
4 | DTT | natural abundance | 10 mM | |
5 | CaCL2 | natural abundance | 5 mM | |
6 | NaCL | natural abundance | 200 mM | |
7 | MES pH 6.5 | natural abundance | 20 mM | |
8 | D2O | natural abundance | 10 % | |
9 | DSS | natural abundance | 50 uM |
Bruker Avance - 800 MHz
State isotropic, Solvent system 95% H2O/5% D2O, Pressure 1 atm, Temperature 298 K, pH 6.5, Details 0.726 mM hsr50.005, 95% H2O/5% D2O
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
10 | hsr50.009 | [U-100% 13C; U-100% 15N; U-2H] | 0.800 mM | |
11 | Proteinase Inhibitors | natural abundance | 1 na | |
12 | NaN3 | natural abundance | 0.02 % | |
13 | DTT | natural abundance | 10 mM | |
14 | CaCL2 | natural abundance | 5 mM | |
15 | NaCL | natural abundance | 200 mM | |
16 | MES pH 6.5 | natural abundance | 20 mM | |
17 | D2O | natural abundance | 10 % | |
18 | DSS | natural abundance | 50 uM |
Bruker Avance - 800 MHz
State isotropic, Solvent system 95% H2O/5% D2O, Pressure 1 atm, Temperature 298 K, pH 6.5, Details 0.726 mM hsr50.005, 95% H2O/5% D2O
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
10 | hsr50.009 | [U-100% 13C; U-100% 15N; U-2H] | 0.800 mM | |
11 | Proteinase Inhibitors | natural abundance | 1 na | |
12 | NaN3 | natural abundance | 0.02 % | |
13 | DTT | natural abundance | 10 mM | |
14 | CaCL2 | natural abundance | 5 mM | |
15 | NaCL | natural abundance | 200 mM | |
16 | MES pH 6.5 | natural abundance | 20 mM | |
17 | D2O | natural abundance | 10 % | |
18 | DSS | natural abundance | 50 uM |
Bruker Avance - 800 MHz
State isotropic, Solvent system 95% H2O/5% D2O, Pressure 1 atm, Temperature 298 K, pH 6.5, Details 0.726 mM hsr50.005, 90% H2O/10% D2O
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | hsr50.005 | [U-100% 13C; U-100% 15N] | 0.726 mM | |
2 | Proteinase Inhibitors | natural abundance | 1 na | |
3 | NaN3 | natural abundance | 0.02 % | |
4 | DTT | natural abundance | 10 mM | |
5 | CaCL2 | natural abundance | 5 mM | |
6 | NaCL | natural abundance | 200 mM | |
7 | MES pH 6.5 | natural abundance | 20 mM | |
8 | D2O | natural abundance | 10 % | |
9 | DSS | natural abundance | 50 uM |
Bruker Avance - 800 MHz
State isotropic, Solvent system 95% H2O/5% D2O, Pressure 1 atm, Temperature 298 K, pH 6.5, Details 0.726 mM hsr50.005, 90% H2O/10% D2O
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | hsr50.005 | [U-100% 13C; U-100% 15N] | 0.726 mM | |
2 | Proteinase Inhibitors | natural abundance | 1 na | |
3 | NaN3 | natural abundance | 0.02 % | |
4 | DTT | natural abundance | 10 mM | |
5 | CaCL2 | natural abundance | 5 mM | |
6 | NaCL | natural abundance | 200 mM | |
7 | MES pH 6.5 | natural abundance | 20 mM | |
8 | D2O | natural abundance | 10 % | |
9 | DSS | natural abundance | 50 uM |
Bruker Avance - 800 MHz
State isotropic, Solvent system 95% H2O/5% D2O, Pressure 1 atm, Temperature 298 K, pH 6.5, Details 0.726 mM hsr50.005, 90% H2O/10% D2O
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | hsr50.005 | [U-100% 13C; U-100% 15N] | 0.726 mM | |
2 | Proteinase Inhibitors | natural abundance | 1 na | |
3 | NaN3 | natural abundance | 0.02 % | |
4 | DTT | natural abundance | 10 mM | |
5 | CaCL2 | natural abundance | 5 mM | |
6 | NaCL | natural abundance | 200 mM | |
7 | MES pH 6.5 | natural abundance | 20 mM | |
8 | D2O | natural abundance | 10 % | |
9 | DSS | natural abundance | 50 uM |
Bruker Avance - 800 MHz
State isotropic, Solvent system 95% H2O/5% D2O, Pressure 1 atm, Temperature 298 K, pH 6.5, Details 0.726 mM hsr50.005, 95% H2O/5% D2O
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
10 | hsr50.009 | [U-100% 13C; U-100% 15N; U-2H] | 0.800 mM | |
11 | Proteinase Inhibitors | natural abundance | 1 na | |
12 | NaN3 | natural abundance | 0.02 % | |
13 | DTT | natural abundance | 10 mM | |
14 | CaCL2 | natural abundance | 5 mM | |
15 | NaCL | natural abundance | 200 mM | |
16 | MES pH 6.5 | natural abundance | 20 mM | |
17 | D2O | natural abundance | 10 % | |
18 | DSS | natural abundance | 50 uM |
Bruker Avance - 900 MHz
State isotropic, Solvent system 95% H2O/5% D2O, Pressure 1 atm, Temperature 298 K, pH 6.5, Details 0.726 mM hsr50.005, 90% H2O/10% D2O
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | hsr50.005 | [U-100% 13C; U-100% 15N] | 0.726 mM | |
2 | Proteinase Inhibitors | natural abundance | 1 na | |
3 | NaN3 | natural abundance | 0.02 % | |
4 | DTT | natural abundance | 10 mM | |
5 | CaCL2 | natural abundance | 5 mM | |
6 | NaCL | natural abundance | 200 mM | |
7 | MES pH 6.5 | natural abundance | 20 mM | |
8 | D2O | natural abundance | 10 % | |
9 | DSS | natural abundance | 50 uM |
Bruker Avance - 900 MHz
State isotropic, Solvent system 95% H2O/5% D2O, Pressure 1 atm, Temperature 298 K, pH 6.5, Details 0.726 mM hsr50.005, 90% H2O/10% D2O
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | hsr50.005 | [U-100% 13C; U-100% 15N] | 0.726 mM | |
2 | Proteinase Inhibitors | natural abundance | 1 na | |
3 | NaN3 | natural abundance | 0.02 % | |
4 | DTT | natural abundance | 10 mM | |
5 | CaCL2 | natural abundance | 5 mM | |
6 | NaCL | natural abundance | 200 mM | |
7 | MES pH 6.5 | natural abundance | 20 mM | |
8 | D2O | natural abundance | 10 % | |
9 | DSS | natural abundance | 50 uM |
Bruker Avance - 800 MHz
State isotropic, Solvent system 95% H2O/5% D2O, Pressure 1 atm, Temperature 298 K, pH 6.5, Details 0.726 mM hsr50.005, 90% H2O/10% D2O
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | hsr50.005 | [U-100% 13C; U-100% 15N] | 0.726 mM | |
2 | Proteinase Inhibitors | natural abundance | 1 na | |
3 | NaN3 | natural abundance | 0.02 % | |
4 | DTT | natural abundance | 10 mM | |
5 | CaCL2 | natural abundance | 5 mM | |
6 | NaCL | natural abundance | 200 mM | |
7 | MES pH 6.5 | natural abundance | 20 mM | |
8 | D2O | natural abundance | 10 % | |
9 | DSS | natural abundance | 50 uM |
Bruker Avance - 800 MHz
State isotropic, Solvent system 95% H2O/5% D2O, Pressure 1 atm, Temperature 298 K, pH 6.5, Details 0.726 mM hsr50.005, 95% H2O/5% D2O
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
10 | hsr50.009 | [U-100% 13C; U-100% 15N; U-2H] | 0.800 mM | |
11 | Proteinase Inhibitors | natural abundance | 1 na | |
12 | NaN3 | natural abundance | 0.02 % | |
13 | DTT | natural abundance | 10 mM | |
14 | CaCL2 | natural abundance | 5 mM | |
15 | NaCL | natural abundance | 200 mM | |
16 | MES pH 6.5 | natural abundance | 20 mM | |
17 | D2O | natural abundance | 10 % | |
18 | DSS | natural abundance | 50 uM |
Varian INOVA - 600 MHz
State anisotropic, Solvent system 95% H2O/5% D2O, Pressure 1 atm, Temperature 298 K, pH 6.5, Details 0.726 mM hsr50.005, 90% H2O/10% D2O
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
19 | hsr50.007 | [U-100% 13C; U-100% 15N] | 0.674 mM | |
20 | Proteinase Inhibitors | natural abundance | 1 na | |
21 | NaN3 | natural abundance | 0.02 % | |
22 | DTT | natural abundance | 10 mM | |
23 | CaCL2 | natural abundance | 5 mM | |
24 | NaCL | natural abundance | 200 mM | |
25 | MES pH 6.5 | natural abundance | 20 mM | |
26 | D2O | natural abundance | 10 % | |
27 | DSS | natural abundance | 50 uM |
Bruker Avance - 800 MHz
State isotropic, Solvent system 95% H2O/5% D2O, Pressure 1 atm, Temperature 298 K, pH 6.5, Details 0.726 mM hsr50.005, 90% H2O/10% D2O
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | hsr50.005 | [U-100% 13C; U-100% 15N] | 0.726 mM | |
2 | Proteinase Inhibitors | natural abundance | 1 na | |
3 | NaN3 | natural abundance | 0.02 % | |
4 | DTT | natural abundance | 10 mM | |
5 | CaCL2 | natural abundance | 5 mM | |
6 | NaCL | natural abundance | 200 mM | |
7 | MES pH 6.5 | natural abundance | 20 mM | |
8 | D2O | natural abundance | 10 % | |
9 | DSS | natural abundance | 50 uM |
Properties
Input source #1: NMR data (NEF) - Assigned chemical shifts, Distance restraints, Dihedral angle restraints, RDC restraints | combined_18215_2lok.nef |
Input source #2: Coordindates | 2lok.cif |
Diamagnetism of the molecular assembly | True (excluding Oxygen atoms) |
Whether the assembly has a disulfide bond | None |
Whether the assembly has a other bond | None |
Whether the assembly contains a cyclic polymer | None |
Overall data processing status | Warning |
Disulfide bonds
NoneOther bonds (neither disulfide, covalent nor hydrogen bonds, e.g. Zinc–sulphur bond)
NoneNon-standard residues
NoneSequence alignments
--------10--------20--------30--------40--------50--------60--------70--------80--------90-------100 MSPIPLPVTDTDDAWRARIAAHRADKDEFLATHDQSPIPPADRGAFDGLRYFDIDASFRVAARYQPARDPEAVELETTRGPPAEYTRAAVLGFDLGDSHH |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||| MSPIPLPVTDTDDAWRARIAAHRADKDEFLATHDQSPIPPADRGAFDGLRYFDIDASFRVAARYQPARDPEAVELETTRGPPAEYTRAAVLGFDLGDSHH -------110-------120-------130-------140-------150-------160-------170-------180-------190------- TLTAFRVEGESSLFVPFTDETTDDGRTYEHGRYLDVDPAGADGGDEVALDFNLAYNPFCAYGGSFSCALPPADNHVPAAITAGERVDADLEHHHHHH ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||| TLTAFRVEGESSLFVPFTDETTDDGRTYEHGRYLDVDPAGADGGDEVALDFNLAYNPFCAYGGSFSCALPPADNHVPAAITAGERVDADLEHHHHHH
Chain assignments
Entity_assembly_ID (NMR) | Auth_asym_ID (model) | Length | Unmapped | Conflict | Sequence coverage (%) |
---|---|---|---|---|---|
A | A | 197 | 0 | 0 | 100.0 |
Content subtype: combined_18215_2lok.nef
Assigned chemical shifts
--------10--------20--------30--------40--------50--------60--------70--------80--------90-------100 MSPIPLPVTDTDDAWRARIAAHRADKDEFLATHDQSPIPPADRGAFDGLRYFDIDASFRVAARYQPARDPEAVELETTRGPPAEYTRAAVLGFDLGDSHH |||||||||||||||||||||||||||||||||||| ||||||||||||||||||||||||||||||||||||||||| ||||||||||||||||||| ..PIPLPVTDTDDAWRARIAAHRADKDEFLATHDQSPI.PADRGAFDGLRYFDIDASFRVAARYQPARDPEAVELETTRG.PAEYTRAAVLGFDLGDSHH --------10--------20--------30--------40--------50--------60--------70--------80--------90-------100 -------110-------120-------130-------140-------150-------160-------170-------180-------190------- TLTAFRVEGESSLFVPFTDETTDDGRTYEHGRYLDVDPAGADGGDEVALDFNLAYNPFCAYGGSFSCALPPADNHVPAAITAGERVDADLEHHHHHH ||||||||||||||||||||||||||||||||||||||||||||||||||||||| ||||||||||||| ||||||||||||||||||||| TLTAFRVEGESSLFVPFTDETTDDGRTYEHGRYLDVDPAGADGGDEVALDFNLAY.PFCAYGGSFSCAL.PADNHVPAAITAGERVDADLE -------110-------120-------130-------140-------150-------160-------170-------180-------190-
Atom group | # of target shifts | # of assigned shifts | Completeness (%) |
---|---|---|---|
13C chemical shifts | 855 | 704 | 82.3 |
1H chemical shifts | 1088 | 829 | 76.2 |
15N chemical shifts | 201 | 169 | 84.1 |
Atom group | # of target shifts | # of assigned shifts | Completeness (%) |
---|---|---|---|
13C chemical shifts | 394 | 356 | 90.4 |
1H chemical shifts | 392 | 358 | 91.3 |
15N chemical shifts | 181 | 166 | 91.7 |
Atom group | # of target shifts | # of assigned shifts | Completeness (%) |
---|---|---|---|
13C chemical shifts | 461 | 348 | 75.5 |
1H chemical shifts | 696 | 471 | 67.7 |
15N chemical shifts | 20 | 3 | 15.0 |
Atom group | # of target shifts | # of assigned shifts | Completeness (%) |
---|---|---|---|
13C chemical shifts | 98 | 97 | 99.0 |
1H chemical shifts | 98 | 97 | 99.0 |
Atom group | # of target shifts | # of assigned shifts | Completeness (%) |
---|---|---|---|
13C chemical shifts | 112 | 58 | 51.8 |
1H chemical shifts | 113 | 69 | 61.1 |
15N chemical shifts | 1 | 1 | 100.0 |
Distance restraints
--------10--------20--------30--------40--------50--------60--------70--------80--------90-------100 MSPIPLPVTDTDDAWRARIAAHRADKDEFLATHDQSPIPPADRGAFDGLRYFDIDASFRVAARYQPARDPEAVELETTRGPPAEYTRAAVLGFDLGDSHH ||||||||||||||||||||||||||||||||||| ||||||||||||||||||||||||||||||||||||||||| ||||||||||||||||||| ...IPLPVTDTDDAWRARIAAHRADKDEFLATHDQSPI.PADRGAFDGLRYFDIDASFRVAARYQPARDPEAVELETTRG.PAEYTRAAVLGFDLGDSHH --------10--------20--------30--------40--------50--------60--------70--------80--------90-------100 -------110-------120-------130-------140-------150-------160-------170-------180-------190------- TLTAFRVEGESSLFVPFTDETTDDGRTYEHGRYLDVDPAGADGGDEVALDFNLAYNPFCAYGGSFSCALPPADNHVPAAITAGERVDADLEHHHHHH ||||||||||||||||||||||||||| ||||||||||||||||||||||||||| |||||||||||| ||||||||||||| ||||||| TLTAFRVEGESSLFVPFTDETTDDGRT.EHGRYLDVDPAGADGGDEVALDFNLAY..FCAYGGSFSCAL.PADNHVPAAITAG.RVDADLE -------110-------120-------130-------140-------150-------160-------170-------180-------190-
Dihedral angle restraints
--------10--------20--------30--------40--------50--------60--------70--------80--------90-------100 MSPIPLPVTDTDDAWRARIAAHRADKDEFLATHDQSPIPPADRGAFDGLRYFDIDASFRVAARYQPARDPEAVELETTRGPPAEYTRAAVLGFDLGDSHH |||| |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||| ..PIPL....TDDAWRARIAAHRADKDEFLATHDQSPIPPADRGAFDGLRYFDIDASFRVAARYQPARDPEAVELETTRGPPAEYTRAAVLGFDLGDSHH --------10--------20--------30--------40--------50--------60--------70--------80--------90-------100 -------110-------120-------130-------140-------150-------160-------170-------180-------190------- TLTAFRVEGESSLFVPFTDETTDDGRTYEHGRYLDVDPAGADGGDEVALDFNLAYNPFCAYGGSFSCALPPADNHVPAAITAGERVDADLEHHHHHH |||||||||||||||||||||||||||||||||||||||||| |||||||||||||||||||||||||||||||||||||||||||||||| TLTAFRVEGESSLFVPFTDETTDDGRTYEHGRYLDVDPAGAD..DEVALDFNLAYNPFCAYGGSFSCALPPADNHVPAAITAGERVDADLEH -------110-------120-------130-------140-------150-------160-------170-------180-------190--
RDC restraints
--------10--------20--------30--------40--------50--------60--------70--------80--------90-------100 MSPIPLPVTDTDDAWRARIAAHRADKDEFLATHDQSPIPPADRGAFDGLRYFDIDASFRVAARYQPARDPEAVELETTRGPPAEYTRAAVLGFDLGDSHH ||||| || ||| | || | | ||| | |||||| | | ||| ||||| ||| || |||| | | ||| |||| .......VTDTD.AW.ARI.A..AD..E.L.THD.S.....DRGAFD.....D.D.SFR.AARYQ.ARD.EA.ELET........T..A.LGF..GDSH. --------10--------20--------30--------40--------50--------60--------70--------80--------90-------100 -------110-------120-------130-------140-------150-------160-------170-------180-------190------- TLTAFRVEGESSLFVPFTDETTDDGRTYEHGRYLDVDPAGADGGDEVALDFNLAYNPFCAYGGSFSCALPPADNHVPAAITAGERVDADLEHHHHHH | ||| ||| || || |||| ||| | || | || ||| ||| ||||| | | ||||| ||||| |||| | T.TAF.VEG.SS.FV..TDET.DDG.T...GR.L.VD.AGA.GGD.VALDF..A.......G.........ADNHV.AAITA..RVDA..E -------110-------120-------130-------140-------150-------160-------170-------180-------190-
--------10--------20--------30--------40--------50--------60--------70--------80--------90-------100 MSPIPLPVTDTDDAWRARIAAHRADKDEFLATHDQSPIPPADRGAFDGLRYFDIDASFRVAARYQPARDPEAVELETTRGPPAEYTRAAVLGFDLGDSHH ||||| || || | ||| | | || | | || |||| | | | ||||||||| ||| || ||||||| | ||||||||| ||||| .......VTDTD.AW..RI.A.RAD..E.L..HD.S.I..AD.GAFD...Y.D.D.SFRVAARYQ.ARD.EA.ELETTRG..A.YTRAAVLGF..GDSHH --------10--------20--------30--------40--------50--------60--------70--------80--------90-------100 -------110-------120-------130-------140-------150-------160-------170-------180-------190------- TLTAFRVEGESSLFVPFTDETTDDGRTYEHGRYLDVDPAGADGGDEVALDFNLAYNPFCAYGGSFSCALPPADNHVPAAITAGERVDADLEHHHHHH | ||| ||| || || |||| ||| | || |||| ||| ||||||||| | ||||||| | | |||| | | |||| | T.TAF.VEG.SS.FV..TDET.DDG.T...GR.LDVD.AGA.GGDEVALDF..A....CAYGGSF.C.L..ADNH....I.A..RVDA..E -------110-------120-------130-------140-------150-------160-------170-------180-------190-