solution structure of FUS/TLS RRM domain
EQDNSDNNTI FVQGLGENVT IESVADYFKQ IGIIKTNKKT GQPMINLYTD RETGKLKGEA TVSFDDPPSA KAAIDWFDGK EFSGNPIKVS FATRRADFNR GGGNGRGG
Polymer type: polypeptide(L)
Total | 1H | 13C | 15N | |
---|---|---|---|---|
All | 88.6 % (1083 of 1222) | 85.4 % (545 of 638) | 90.3 % (421 of 466) | 99.2 % (117 of 118) |
Backbone | 96.1 % (615 of 640) | 93.8 % (212 of 226) | 96.8 % (300 of 310) | 99.0 % (103 of 104) |
Sidechain | 82.7 % (559 of 676) | 80.8 % (333 of 412) | 84.8 % (212 of 250) | 100.0 % (14 of 14) |
Aromatic | 42.9 % (42 of 98) | 46.9 % (23 of 49) | 37.5 % (18 of 48) | 100.0 % (1 of 1) |
Methyl | 95.7 % (90 of 94) | 95.7 % (45 of 47) | 95.7 % (45 of 47) |
1. FUS/TLS RRM domain
EQDNSDNNTI FVQGLGENVT IESVADYFKQ IGIIKTNKKT GQPMINLYTD RETGKLKGEA TVSFDDPPSA KAAIDWFDGK EFSGNPIKVS FATRRADFNR GGGNGRGGSolvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 7.0
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | DSS | natural abundance | 0.5 mM | |
2 | Tris | natural abundance | 20 mM | |
3 | NaCl | natural abundance | 50 mM | |
4 | H2O | natural abundance | 10 % | |
5 | D2O | [U-100% 2H] | 90 % | |
6 | NaN3 | natural abundance | 0.02 % | |
7 | FUS_TLS_RRM_domain | [U-100% 15N; U-100% 13C] | 1 mM |
Atom type | Mol. common name | Atom group | Value | Ref. method | Ref. type | Shift ratio |
---|---|---|---|---|---|---|
13C | DSS | methyl protons | 0.0 ppm | internal | indirect | 0.2514495 |
1H | DSS | methyl protons | 0.0 ppm | internal | direct | 1.0 |
15N | DSS | methyl protons | 0.0 ppm | internal | indirect | 0.1013291 |
Atom type | Mol. common name | Atom group | Value | Ref. method | Ref. type | Shift ratio |
---|---|---|---|---|---|---|
13C | DSS | methyl protons | 0.0 ppm | internal | indirect | 0.2514495 |
1H | DSS | methyl protons | 0.0 ppm | internal | direct | 1.0 |
15N | DSS | methyl protons | 0.0 ppm | internal | indirect | 0.1013291 |
Atom type | Mol. common name | Atom group | Value | Ref. method | Ref. type | Shift ratio |
---|---|---|---|---|---|---|
13C | DSS | methyl protons | 0.0 ppm | internal | indirect | 0.2514495 |
1H | DSS | methyl protons | 0.0 ppm | internal | direct | 1.0 |
15N | DSS | methyl protons | 0.0 ppm | internal | indirect | 0.1013291 |
Atom type | Mol. common name | Atom group | Value | Ref. method | Ref. type | Shift ratio |
---|---|---|---|---|---|---|
13C | DSS | methyl protons | 0.0 ppm | internal | indirect | 0.2514495 |
1H | DSS | methyl protons | 0.0 ppm | internal | direct | 1.0 |
15N | DSS | methyl protons | 0.0 ppm | internal | indirect | 0.1013291 |
Bruker DRX - 600 MHz
State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 7.0
# | Name | Isotope labeling | Type | Concentration |
---|---|---|---|---|
1 | DSS | natural abundance | 0.5 mM | |
2 | Tris | natural abundance | 20 mM | |
3 | NaCl | natural abundance | 50 mM | |
4 | H2O | natural abundance | 10 % | |
5 | D2O | [U-100% 2H] | 90 % | |
6 | NaN3 | natural abundance | 0.02 % | |
7 | FUS_TLS_RRM_domain | [U-100% 15N; U-100% 13C] | 1 mM |
Properties
Input source #1: NMR data (NEF) - Assigned chemical shifts, Distance restraints, Dihedral angle restraints | combined_17635_2lcw.nef |
Input source #2: Coordindates | 2lcw.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
--280-----290-------300-------310-------320-------330-------340-------350-------360-------370------- EQDNSDNNTIFVQGLGENVTIESVADYFKQIGIIKTNKKTGQPMINLYTDRETGKLKGEATVSFDDPPSAKAAIDWFDGKEFSGNPIKVSFATRRADFNR |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||| EQDNSDNNTIFVQGLGENVTIESVADYFKQIGIIKTNKKTGQPMINLYTDRETGKLKGEATVSFDDPPSAKAAIDWFDGKEFSGNPIKVSFATRRADFNR --------10--------20--------30--------40--------50--------60--------70--------80--------90-------100 380-------390--- GGGNGRGGLEHHHHHH |||||||||||||||| GGGNGRGGLEHHHHHH -------110------
Chain assignments
Entity_assembly_ID (NMR) | Auth_asym_ID (model) | Length | Unmapped | Conflict | Sequence coverage (%) |
---|---|---|---|---|---|
A | A | 116 | 0 | 0 | 100.0 |
Content subtype: combined_17635_2lcw.nef
Assigned chemical shifts
--280-----290-------300-------310-------320-------330-------340-------350-------360-------370------- EQDNSDNNTIFVQGLGENVTIESVADYFKQIGIIKTNKKTGQPMINLYTDRETGKLKGEATVSFDDPPSAKAAIDWFDGKEFSGNPIKVSFATRRADFNR |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||| EQDNSDNNTIFVQGLGENVTIESVADYFKQIGIIKTNKKTGQPMINLYTDRETGKLKGEATVSFDDPPSAKAAIDWFDGKEFSGNPIKVSFATRRADFNR --280-----290-------300-------310-------320-------330-------340-------350-------360-------370------- 380-------390--- GGGNGRGGLEHHHHHH |||||||| GGGNGRGG 380-----
Comp_index_ID | Comp_ID | Atom_ID | CS value (ppm) |
---|---|---|---|
279 | GLN | CD | 182.095 |
281 | ASN | CG | 173.005 |
284 | ASN | CG | 173.792 |
290 | GLN | CD | 181.893 |
295 | ASN | CG | 172.618 |
307 | GLN | CD | 182.286 |
314 | ASN | CG | 173.207 |
319 | GLN | CD | 182.295 |
323 | ASN | CG | 173.942 |
362 | ASN | CG | 173.345 |
376 | ASN | CG | 173.452 |
381 | ASN | CG | 173.294 |
Atom group | # of target shifts | # of assigned shifts | Completeness (%) |
---|---|---|---|
1H chemical shifts | 687 | 561 | 81.7 |
13C chemical shifts | 506 | 434 | 85.8 |
15N chemical shifts | 131 | 117 | 89.3 |
Atom group | # of target shifts | # of assigned shifts | Completeness (%) |
---|---|---|---|
1H chemical shifts | 242 | 219 | 90.5 |
13C chemical shifts | 232 | 215 | 92.7 |
15N chemical shifts | 112 | 103 | 92.0 |
Atom group | # of target shifts | # of assigned shifts | Completeness (%) |
---|---|---|---|
1H chemical shifts | 445 | 342 | 76.9 |
13C chemical shifts | 274 | 219 | 79.9 |
15N chemical shifts | 19 | 14 | 73.7 |
Atom group | # of target shifts | # of assigned shifts | Completeness (%) |
---|---|---|---|
1H chemical shifts | 50 | 48 | 96.0 |
13C chemical shifts | 50 | 48 | 96.0 |
Atom group | # of target shifts | # of assigned shifts | Completeness (%) |
---|---|---|---|
1H chemical shifts | 61 | 23 | 37.7 |
13C chemical shifts | 60 | 18 | 30.0 |
15N chemical shifts | 1 | 1 | 100.0 |
Distance restraints
--280-----290-------300-------310-------320-------330-------340-------350-------360-------370------- EQDNSDNNTIFVQGLGENVTIESVADYFKQIGIIKTNKKTGQPMINLYTDRETGKLKGEATVSFDDPPSAKAAIDWFDGKEFSGNPIKVSFATRRADFNR |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||| EQDNSDNNTIFVQGLGENVTIESVADYFKQIGIIKTNKKTGQPMINLYTDRETGKLKGEATVSFDDPPSAKAAIDWFDGKEFSGNPIKVSFATRRADFNR --280-----290-------300-------310-------320-------330-------340-------350-------360-------370------- 380-------390--- GGGNGRGGLEHHHHHH || ||||| GG.NGRGG 380-----
Dihedral angle restraints
--280-----290-------300-------310-------320-------330-------340-------350-------360-------370------- EQDNSDNNTIFVQGLGENVTIESVADYFKQIGIIKTNKKTGQPMINLYTDRETGKLKGEATVSFDDPPSAKAAIDWFDGKEFSGNPIKVSFATRRADFNR |||| |||||| |||||||||| |||||| ||||||||||| ||||||| ||||||||||| |||||||||||| ...NSDN.TIFVQG....VTIESVADYF...GIIKTN...GQPMINLYTDR......GEATVSF..PPSAKAAIDWF..KEFSGNPIKVSF......... --280-----290-------300-------310-------320-------330-------340-------350-------360-------370------- 380-------390--- GGGNGRGGLEHHHHHH ||| ....GRG 380----