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BMRB: 6484

2CXJ

Backbone 1H, 13C, and 15N Chemical Shift Assignments for S100A13

Authors

Vaithiyalingam, S., Thallapuranam, S.KRISHNASWAMY., Chin, Y.

Assembly

S100A13

Entity

1. S100A13 (polymer, Thiol state: not present), 101 monomers, 11483.10 Da Detail

LVLMAAETLT ELEAAIETVV STFFTFAGRE GRKGSLNINE FKELATQQLP HLLKDVGSLD EKMKTLDVNQ DSELRFSEYW RLIGELAKEV RKEKALGIRK K

Formula weight

11483.1 Da

Source organism

Exptl. method

Refine. method

torsion angle dynamics

Data set

assigned_chemical_shifts

Chem. Shift Complete

Sequence coverage: 100.0 %, Completeness: 91.0 %, Completeness (bb): 98.3 % Detail

Polymer type: polypeptide(L)

	Total	¹H	¹³C	¹⁵N
All	91.0 % (1104 of 1213)	90.4 % (572 of 633)	91.3 % (432 of 473)	93.5 % (100 of 107)
Backbone	98.3 % (594 of 604)	98.1 % (203 of 207)	99.0 % (294 of 297)	97.0 % (97 of 100)
Sidechain	85.9 % (605 of 704)	86.6 % (369 of 426)	86.0 % (233 of 271)	42.9 % (3 of 7)
Aromatic	48.6 % (36 of 74)	64.9 % (24 of 37)	30.6 % (11 of 36)	100.0 % (1 of 1)
Methyl	94.6 % (123 of 130)	95.4 % (62 of 65)	93.8 % (61 of 65)

1. S100A13

LVLMAAETLT ELEAAIETVV STFFTFAGRE GRKGSLNINE FKELATQQLP HLLKDVGSLD EKMKTLDVNQ DSELRFSEYW RLIGELAKEV RKEKALGIRK K

Show sample condition

Sample

Temperature 298 (±0.2) K

#	Name	Isotope labeling	Type	Concentration
1	S100A13	[U-95% 13C; U-90% 15N]		0.75 mM
2	KCl			25 mM
3	Tris HCl(Deutrated)			25 mM
4	Calcium			2 mM
5	NaN			0.3 mM

LACS Plot; CA

Referencing offset: 3.04 ppm, Outliers: 1 Detail

LACS Plot; CB

Referencing offset: 3.04 ppm, Outliers: 1 Detail

LACS Plot; HA

Referencing offset: 0.05 ppm, Outliers: 2 Detail

LACS Plot; CO

Referencing offset: 2.24 ppm, Outliers: 3 Detail

Protein Blocks Logo

Calculated from 20 models in PDB: 2CXJ, Strand ID: A, B Detail

Release date

2006-02-16

Citation

Resonance assignments for mouse S100A13
Sivaraja, V., Suresh Kumar, T.K., Yu, C.
J. Biomol. NMR (2005), 32, 257-257, PubMed 16132827 , DOI 10.1007/s10858-005-6730-9 , Abstract

Related entities 1. S100A13, : 1 : 2 : 66 entities Detail

Interaction partners 1. S100A13, : 4 interactors Detail

More details for 4 interactors identified by 2 citations

Experiments performed 17 experiments Detail

1 1H15N HSQC

Instrument

Bruker Avance - 700 MHz Bruker 700 MHz equipped with a cryoprobe

Sample

State isotropic, Temperature 298 (±0.2) K

#	Name	Isotope labeling	Type	Concentration
1	S100A13	[U-95% 13C; U-90% 15N]		0.75 mM
2	KCl			25 mM
3	Tris HCl(Deutrated)			25 mM
4	Calcium			2 mM
5	NaN			0.3 mM

2 1H-NOESY

Instrument

Bruker Avance - 700 MHz Bruker 700 MHz equipped with a cryoprobe

Sample

State isotropic, Temperature 298 (±0.2) K

#	Name	Isotope labeling	Type	Concentration
1	S100A13	[U-95% 13C; U-90% 15N]		0.75 mM
2	KCl			25 mM
3	Tris HCl(Deutrated)			25 mM
4	Calcium			2 mM
5	NaN			0.3 mM

3 1H-DIPSY

Instrument

Bruker Avance - 700 MHz Bruker 700 MHz equipped with a cryoprobe

Sample

State isotropic, Temperature 298 (±0.2) K

#	Name	Isotope labeling	Type	Concentration
1	S100A13	[U-95% 13C; U-90% 15N]		0.75 mM
2	KCl			25 mM
3	Tris HCl(Deutrated)			25 mM
4	Calcium			2 mM
5	NaN			0.3 mM

4 HNCA

Instrument

Bruker Avance - 700 MHz Bruker 700 MHz equipped with a cryoprobe

Sample

State isotropic, Temperature 298 (±0.2) K

#	Name	Isotope labeling	Type	Concentration
1	S100A13	[U-95% 13C; U-90% 15N]		0.75 mM
2	KCl			25 mM
3	Tris HCl(Deutrated)			25 mM
4	Calcium			2 mM
5	NaN			0.3 mM

5 HNCOCA

Instrument

Bruker Avance - 700 MHz Bruker 700 MHz equipped with a cryoprobe

Sample

State isotropic, Temperature 298 (±0.2) K

#	Name	Isotope labeling	Type	Concentration
1	S100A13	[U-95% 13C; U-90% 15N]		0.75 mM
2	KCl			25 mM
3	Tris HCl(Deutrated)			25 mM
4	Calcium			2 mM
5	NaN			0.3 mM

6 HNCACB

Instrument

Bruker Avance - 700 MHz Bruker 700 MHz equipped with a cryoprobe

Sample

State isotropic, Temperature 298 (±0.2) K

#	Name	Isotope labeling	Type	Concentration
1	S100A13	[U-95% 13C; U-90% 15N]		0.75 mM
2	KCl			25 mM
3	Tris HCl(Deutrated)			25 mM
4	Calcium			2 mM
5	NaN			0.3 mM

7 CBCACONH

Instrument

Bruker Avance - 700 MHz Bruker 700 MHz equipped with a cryoprobe

Sample

State isotropic, Temperature 298 (±0.2) K

#	Name	Isotope labeling	Type	Concentration
1	S100A13	[U-95% 13C; U-90% 15N]		0.75 mM
2	KCl			25 mM
3	Tris HCl(Deutrated)			25 mM
4	Calcium			2 mM
5	NaN			0.3 mM

8 HNCO

Instrument

Bruker Avance - 700 MHz Bruker 700 MHz equipped with a cryoprobe

Sample

State isotropic, Temperature 298 (±0.2) K

#	Name	Isotope labeling	Type	Concentration
1	S100A13	[U-95% 13C; U-90% 15N]		0.75 mM
2	KCl			25 mM
3	Tris HCl(Deutrated)			25 mM
4	Calcium			2 mM
5	NaN			0.3 mM

9 HNCACO

Instrument

Bruker Avance - 700 MHz Bruker 700 MHz equipped with a cryoprobe

Sample

State isotropic, Temperature 298 (±0.2) K

#	Name	Isotope labeling	Type	Concentration
1	S100A13	[U-95% 13C; U-90% 15N]		0.75 mM
2	KCl			25 mM
3	Tris HCl(Deutrated)			25 mM
4	Calcium			2 mM
5	NaN			0.3 mM

10 HBHACONH

Instrument

Bruker Avance - 700 MHz Bruker 700 MHz equipped with a cryoprobe

Sample

State isotropic, Temperature 298 (±0.2) K

#	Name	Isotope labeling	Type	Concentration
1	S100A13	[U-95% 13C; U-90% 15N]		0.75 mM
2	KCl			25 mM
3	Tris HCl(Deutrated)			25 mM
4	Calcium			2 mM
5	NaN			0.3 mM

11 CC(CO)NH-TOCSY -1H

Instrument

Bruker Avance - 700 MHz Bruker 700 MHz equipped with a cryoprobe

Sample

State isotropic, Temperature 298 (±0.2) K

#	Name	Isotope labeling	Type	Concentration
1	S100A13	[U-95% 13C; U-90% 15N]		0.75 mM
2	KCl			25 mM
3	Tris HCl(Deutrated)			25 mM
4	Calcium			2 mM
5	NaN			0.3 mM

12 CC(CO)NH-TOCSY-13C

Instrument

Bruker Avance - 700 MHz Bruker 700 MHz equipped with a cryoprobe

Sample

State isotropic, Temperature 298 (±0.2) K

#	Name	Isotope labeling	Type	Concentration
1	S100A13	[U-95% 13C; U-90% 15N]		0.75 mM
2	KCl			25 mM
3	Tris HCl(Deutrated)			25 mM
4	Calcium			2 mM
5	NaN			0.3 mM

13 HNHA

Instrument

Bruker Avance - 700 MHz Bruker 700 MHz equipped with a cryoprobe

Sample

State isotropic, Temperature 298 (±0.2) K

#	Name	Isotope labeling	Type	Concentration
1	S100A13	[U-95% 13C; U-90% 15N]		0.75 mM
2	KCl			25 mM
3	Tris HCl(Deutrated)			25 mM
4	Calcium			2 mM
5	NaN			0.3 mM

14 15 HSQC-NOESY

Instrument

Bruker Avance - 700 MHz Bruker 700 MHz equipped with a cryoprobe

Sample

State isotropic, Temperature 298 (±0.2) K

#	Name	Isotope labeling	Type	Concentration
1	S100A13	[U-95% 13C; U-90% 15N]		0.75 mM
2	KCl			25 mM
3	Tris HCl(Deutrated)			25 mM
4	Calcium			2 mM
5	NaN			0.3 mM

15 13C HSQC-NOESY

Instrument

Bruker Avance - 700 MHz Bruker 700 MHz equipped with a cryoprobe

Sample

State isotropic, Temperature 298 (±0.2) K

#	Name	Isotope labeling	Type	Concentration
1	S100A13	[U-95% 13C; U-90% 15N]		0.75 mM
2	KCl			25 mM
3	Tris HCl(Deutrated)			25 mM
4	Calcium			2 mM
5	NaN			0.3 mM

16 HCCH-TOCSY

Instrument

Bruker Avance - 700 MHz Bruker 700 MHz equipped with a cryoprobe

Sample

State isotropic, Temperature 298 (±0.2) K

#	Name	Isotope labeling	Type	Concentration
1	S100A13	[U-95% 13C; U-90% 15N]		0.75 mM
2	KCl			25 mM
3	Tris HCl(Deutrated)			25 mM
4	Calcium			2 mM
5	NaN			0.3 mM

17 15N HSQC-DIPSY

Instrument

Bruker Avance - 700 MHz Bruker 700 MHz equipped with a cryoprobe

Sample

State isotropic, Temperature 298 (±0.2) K

#	Name	Isotope labeling	Type	Concentration
1	S100A13	[U-95% 13C; U-90% 15N]		0.75 mM
2	KCl			25 mM
3	Tris HCl(Deutrated)			25 mM
4	Calcium			2 mM
5	NaN			0.3 mM

nullKeywords NMR