Solution Structure of ETS Transcription Factor PU.1
HIHMGSKKKI RLYQFLLDLL RSGDMKDSIW WVDKDKGTFQ FSSKHKEALA HRWGIQKGNR KKMTYQKMAR ALRNYGKTGE VKKVKKKLTY QFSGEVLGRG GLAERRLPPH
Polymer type: polypeptide(L)
Total | 1H | 13C | 15N | |
---|---|---|---|---|
All | 84.7 % (1176 of 1388) | 80.1 % (593 of 740) | 88.7 % (470 of 530) | 95.8 % (113 of 118) |
Backbone | 95.6 % (627 of 656) | 93.9 % (215 of 229) | 96.9 % (309 of 319) | 95.4 % (103 of 108) |
Sidechain | 77.6 % (645 of 831) | 74.0 % (378 of 511) | 82.9 % (257 of 310) | 100.0 % (10 of 10) |
Aromatic | 59.4 % (76 of 128) | 60.9 % (39 of 64) | 55.7 % (34 of 61) | 100.0 % (3 of 3) |
Methyl | 95.7 % (90 of 94) | 93.6 % (44 of 47) | 97.9 % (46 of 47) |
1. Transcription factor PU.1
HIHMGSKKKI RLYQFLLDLL RSGDMKDSIW WVDKDKGTFQ FSSKHKEALA HRWGIQKGNR KKMTYQKMAR ALRNYGKTGE VKKVKKKLTY QFSGEVLGRG GLAERRLPPHSolvent system 95% H2O/5% D2O, Pressure 1 atm, Temperature 298 K, pH 5.5, Details 0.3 mM [U-99% 13C; U-99% 15N] DNA binding protein, 95% H2O/5% D2O
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | DNA binding protein | [U-99% 13C; U-99% 15N] | 0.3 mM | |
2 | potassium chloride | natural abundance | 150 mM |
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 AvanceIII - 850 MHz
State isotropic, Solvent system 95% H2O/5% D2O, Pressure 1 atm, Temperature 298 K, pH 5.5, Details 0.3 mM [U-99% 13C; U-99% 15N] DNA binding protein, 95% H2O/5% D2O
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | DNA binding protein | [U-99% 13C; U-99% 15N] | 0.3 mM | |
2 | potassium chloride | natural abundance | 150 mM |
Bruker AvanceIII - 850 MHz
State isotropic, Solvent system 95% H2O/5% D2O, Pressure 1 atm, Temperature 298 K, pH 5.5, Details 0.3 mM [U-99% 13C; U-99% 15N] DNA binding protein, 95% H2O/5% D2O
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | DNA binding protein | [U-99% 13C; U-99% 15N] | 0.3 mM | |
2 | potassium chloride | natural abundance | 150 mM |
Bruker AvanceIII - 850 MHz
State isotropic, Solvent system 95% H2O/5% D2O, Pressure 1 atm, Temperature 298 K, pH 5.5, Details 0.3 mM [U-99% 13C; U-99% 15N] DNA binding protein, 95% H2O/5% D2O
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | DNA binding protein | [U-99% 13C; U-99% 15N] | 0.3 mM | |
2 | potassium chloride | natural abundance | 150 mM |
Bruker AvanceIII - 850 MHz
State isotropic, Solvent system 95% H2O/5% D2O, Pressure 1 atm, Temperature 298 K, pH 5.5, Details 0.3 mM [U-99% 13C; U-99% 15N] DNA binding protein, 95% H2O/5% D2O
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | DNA binding protein | [U-99% 13C; U-99% 15N] | 0.3 mM | |
2 | potassium chloride | natural abundance | 150 mM |
Bruker AvanceIII - 850 MHz
State isotropic, Solvent system 95% H2O/5% D2O, Pressure 1 atm, Temperature 298 K, pH 5.5, Details 0.3 mM [U-99% 13C; U-99% 15N] DNA binding protein, 95% H2O/5% D2O
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | DNA binding protein | [U-99% 13C; U-99% 15N] | 0.3 mM | |
2 | potassium chloride | natural abundance | 150 mM |
Bruker AvanceIII - 850 MHz
State isotropic, Solvent system 95% H2O/5% D2O, Pressure 1 atm, Temperature 298 K, pH 5.5, Details 0.3 mM [U-99% 13C; U-99% 15N] DNA binding protein, 95% H2O/5% D2O
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | DNA binding protein | [U-99% 13C; U-99% 15N] | 0.3 mM | |
2 | potassium chloride | natural abundance | 150 mM |
Bruker AvanceIII - 850 MHz
State isotropic, Solvent system 95% H2O/5% D2O, Pressure 1 atm, Temperature 298 K, pH 5.5, Details 0.3 mM [U-99% 13C; U-99% 15N] DNA binding protein, 95% H2O/5% D2O
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | DNA binding protein | [U-99% 13C; U-99% 15N] | 0.3 mM | |
2 | potassium chloride | natural abundance | 150 mM |
Bruker AvanceIII - 850 MHz
State isotropic, Solvent system 95% H2O/5% D2O, Pressure 1 atm, Temperature 298 K, pH 5.5, Details 0.3 mM [U-99% 13C; U-99% 15N] DNA binding protein, 95% H2O/5% D2O
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | DNA binding protein | [U-99% 13C; U-99% 15N] | 0.3 mM | |
2 | potassium chloride | natural abundance | 150 mM |
Properties
Input source #1: NMR data (NEF) - Assigned chemical shifts, Distance restraints | combined_30303_5w3g.nef |
Input source #2: Coordindates | 5w3g.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
-----170-------180-------190-------200-------210-------220-------230-------240-------250-------260-- HIHMGSKKKIRLYQFLLDLLRSGDMKDSIWWVDKDKGTFQFSSKHKEALAHRWGIQKGNRKKMTYQKMARALRNYGKTGEVKKVKKKLTYQFSGEVLGRG |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||| HIHMGSKKKIRLYQFLLDLLRSGDMKDSIWWVDKDKGTFQFSSKHKEALAHRWGIQKGNRKKMTYQKMARALRNYGKTGEVKKVKKKLTYQFSGEVLGRG --------10--------20--------30--------40--------50--------60--------70--------80--------90-------100 -----270-- GLAERRLPPH |||||||||| GLAERRLPPH -------110
Chain assignments
Entity_assembly_ID (NMR) | Auth_asym_ID (model) | Length | Unmapped | Conflict | Sequence coverage (%) |
---|---|---|---|---|---|
A | A | 110 | 0 | 0 | 100.0 |
Content subtype: combined_30303_5w3g.nef
Assigned chemical shifts
-----170-------180-------190-------200-------210-------220-------230-------240-------250-------260-- HIHMGSKKKIRLYQFLLDLLRSGDMKDSIWWVDKDKGTFQFSSKHKEALAHRWGIQKGNRKKMTYQKMARALRNYGKTGEVKKVKKKLTYQFSGEVLGRG ||||||| |||||||||||||||| ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||| HIHMGSK.KIRLYQFLLDLLRSGD.KDSIWWVDKDKGTFQFSSKHKEALAHRWGIQKGNRKKMTYQKMARALRNYGKTGEVKKVKKKLTYQFSGEVLGRG -----270-- GLAERRLPPH ||||||| || GLAERRL.PH
Atom group | # of target shifts | # of assigned shifts | Completeness (%) |
---|---|---|---|
1H chemical shifts | 740 | 581 | 78.5 |
13C chemical shifts | 530 | 464 | 87.5 |
15N chemical shifts | 127 | 113 | 89.0 |
Atom group | # of target shifts | # of assigned shifts | Completeness (%) |
---|---|---|---|
1H chemical shifts | 229 | 213 | 93.0 |
13C chemical shifts | 220 | 213 | 96.8 |
15N chemical shifts | 108 | 103 | 95.4 |
Atom group | # of target shifts | # of assigned shifts | Completeness (%) |
---|---|---|---|
1H chemical shifts | 511 | 368 | 72.0 |
13C chemical shifts | 310 | 251 | 81.0 |
15N chemical shifts | 19 | 10 | 52.6 |
Atom group | # of target shifts | # of assigned shifts | Completeness (%) |
---|---|---|---|
1H chemical shifts | 51 | 42 | 82.4 |
13C chemical shifts | 51 | 44 | 86.3 |
Atom group | # of target shifts | # of assigned shifts | Completeness (%) |
---|---|---|---|
1H chemical shifts | 64 | 39 | 60.9 |
13C chemical shifts | 61 | 34 | 55.7 |
15N chemical shifts | 3 | 3 | 100.0 |
Distance restraints
-----170-------180-------190-------200-------210-------220-------230-------240-------250-------260-- HIHMGSKKKIRLYQFLLDLLRSGDMKDSIWWVDKDKGTFQFSSKHKEALAHRWGIQKGNRKKMTYQKMARALRNYGKTGEVKKVKKKLTYQFSGEVLGRG || || ||||||||||||||| |||||||||||||||||||||||||| ||||||||||||||||||||||||||||||||||||||||||||||| HI...SK.KIRLYQFLLDLLRSG..KDSIWWVDKDKGTFQFSSKHKEALAH.WGIQKGNRKKMTYQKMARALRNYGKTGEVKKVKKKLTYQFSGEVLGR. -----170-------180-------190-------200-------210-------220-------230-------240-------250-------260-- -----270-- GLAERRLPPH |||||| .LAERRL -------