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BMRB: 6515

1YYC

Chemical Shift Assignments for At2g46140.1

Authors

Assembly

At2g46140

Entity

1. At2g46140 (polymer, Thiol state: all free), 174 monomers, 18837.16 Da Detail

GHHHHHHLEA SADEKVVEEK ASVISSLLDK AKGFFAEKLA NIPTPEATVD DVDFKGVTRD GVDYHAKVSV KNPYSQSIPI CQISYILKSA TRTIASGTIP DPGSLVGSGT TVLDVPVKVA YSIAVSLMKD MCTDWDIDYQ LDIGLTFDIP VVGDITIPVS TQGEIKLPSL RDFF

Formula weight

18837.16 Da

Source organism

Arabidopsis thaliana

Exptl. method

Data set

assigned_chemical_shifts

Chem. Shift Complete

Sequence coverage: 97.1 %, Completeness: 80.1 %, Completeness (bb): 94.9 % Detail

Polymer type: polypeptide(L)

	Total	¹H	¹³C	¹⁵N
All	80.1 % (1567 of 1956)	75.5 % (754 of 999)	82.4 % (648 of 786)	96.5 % (165 of 171)
Backbone	94.9 % (972 of 1024)	94.6 % (330 of 349)	94.7 % (484 of 511)	96.3 % (158 of 164)
Sidechain	68.8 % (753 of 1095)	65.2 % (424 of 650)	73.5 % (322 of 438)	100.0 % (7 of 7)
Aromatic	20.0 % (28 of 140)	32.9 % (23 of 70)	5.8 % (4 of 69)	100.0 % (1 of 1)
Methyl	88.2 % (201 of 228)	89.5 % (102 of 114)	86.8 % (99 of 114)

1. At2g46140

GHHHHHHLEA SADEKVVEEK ASVISSLLDK AKGFFAEKLA NIPTPEATVD DVDFKGVTRD GVDYHAKVSV KNPYSQSIPI CQISYILKSA TRTIASGTIP DPGSLVGSGT TVLDVPVKVA YSIAVSLMKD MCTDWDIDYQ LDIGLTFDIP VVGDITIPVS TQGEIKLPSL RDFF

Show sample condition

Sample

Pressure 1 (±0.1) atm, Temperature 298 (±0.1) K, pH 7.0 (±0.1)

#	Name	Isotope labeling	Type	Concentration
1	At2g46140	[U-13C; U-15N]		0.4 mM
2	NaCl			100 mM
3	DTT			10 mM
4	Bis-Tris			10 mM

LACS Plot; CA

Referencing offset: -0.15 ppm, Outliers: 2 Detail

LACS Plot; CB

Referencing offset: -0.15 ppm, Outliers: 2 Detail

LACS Plot; HA

Referencing offset: -0.11 ppm, Outliers: 5 Detail

LACS Plot; CO

Referencing offset: 1.32 ppm, Outliers: 1 Detail

Release date

2005-04-25

Citation

No title is available
Song, J., Tyler, R.C., Lee, M.S., Markley, J.L.

Related entities 1. At2g46140, : 1 : 2 : 21 entities Detail

Experiments performed 10 experiments Detail

1 HNCACB

Instrument

Varian Inova - 600 MHz

Sample

State isotropic, Pressure 1 (±0.1) atm, Temperature 298 (±0.1) K, pH 7.0 (±0.1)

#	Name	Isotope labeling	Type	Concentration
1	At2g46140	[U-13C; U-15N]		0.4 mM
2	NaCl			100 mM
3	DTT			10 mM
4	Bis-Tris			10 mM

2 HNCOCACB

Instrument

Varian Inova - 600 MHz

Sample

State isotropic, Pressure 1 (±0.1) atm, Temperature 298 (±0.1) K, pH 7.0 (±0.1)

#	Name	Isotope labeling	Type	Concentration
1	At2g46140	[U-13C; U-15N]		0.4 mM
2	NaCl			100 mM
3	DTT			10 mM
4	Bis-Tris			10 mM

3 HNCO

Instrument

Varian Inova - 600 MHz

Sample

State isotropic, Pressure 1 (±0.1) atm, Temperature 298 (±0.1) K, pH 7.0 (±0.1)

#	Name	Isotope labeling	Type	Concentration
1	At2g46140	[U-13C; U-15N]		0.4 mM
2	NaCl			100 mM
3	DTT			10 mM
4	Bis-Tris			10 mM

4 HCCHTOCSY

Instrument

Varian Inova - 600 MHz

Sample

State isotropic, Pressure 1 (±0.1) atm, Temperature 298 (±0.1) K, pH 7.0 (±0.1)

#	Name	Isotope labeling	Type	Concentration
1	At2g46140	[U-13C; U-15N]		0.4 mM
2	NaCl			100 mM
3	DTT			10 mM
4	Bis-Tris			10 mM

5 CCONH

Instrument

Varian Inova - 600 MHz

Sample

State isotropic, Pressure 1 (±0.1) atm, Temperature 298 (±0.1) K, pH 7.0 (±0.1)

#	Name	Isotope labeling	Type	Concentration
1	At2g46140	[U-13C; U-15N]		0.4 mM
2	NaCl			100 mM
3	DTT			10 mM
4	Bis-Tris			10 mM

6 HCCONH

Instrument

Varian Inova - 600 MHz

Sample

State isotropic, Pressure 1 (±0.1) atm, Temperature 298 (±0.1) K, pH 7.0 (±0.1)

#	Name	Isotope labeling	Type	Concentration
1	At2g46140	[U-13C; U-15N]		0.4 mM
2	NaCl			100 mM
3	DTT			10 mM
4	Bis-Tris			10 mM

7 3D N15NOESY

Instrument

Varian Inova - 600 MHz

Sample

State isotropic, Pressure 1 (±0.1) atm, Temperature 298 (±0.1) K, pH 7.0 (±0.1)

#	Name	Isotope labeling	Type	Concentration
1	At2g46140	[U-13C; U-15N]		0.4 mM
2	NaCl			100 mM
3	DTT			10 mM
4	Bis-Tris			10 mM

8 3D C13NOESY

Instrument

Varian Inova - 600 MHz

Sample

State isotropic, Pressure 1 (±0.1) atm, Temperature 298 (±0.1) K, pH 7.0 (±0.1)

#	Name	Isotope labeling	Type	Concentration
1	At2g46140	[U-13C; U-15N]		0.4 mM
2	NaCl			100 mM
3	DTT			10 mM
4	Bis-Tris			10 mM

9 N15 HSQC

Instrument

Varian Inova - 600 MHz

Sample

State isotropic, Pressure 1 (±0.1) atm, Temperature 298 (±0.1) K, pH 7.0 (±0.1)

#	Name	Isotope labeling	Type	Concentration
1	At2g46140	[U-13C; U-15N]		0.4 mM
2	NaCl			100 mM
3	DTT			10 mM
4	Bis-Tris			10 mM

10 HBACONH

Instrument

Varian Inova - 600 MHz

Sample

State isotropic, Pressure 1 (±0.1) atm, Temperature 298 (±0.1) K, pH 7.0 (±0.1)

#	Name	Isotope labeling	Type	Concentration
1	At2g46140	[U-13C; U-15N]		0.4 mM
2	NaCl			100 mM
3	DTT			10 mM
4	Bis-Tris			10 mM

Chemical shift validation 3 contents Detail

Properties

Input source #1: Assigned chemical shifts - Assigned chemical shifts	bmr6515_3.str
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

None

Other bonds (neither disulfide, covalent nor hydrogen bonds, e.g. Zinc–sulphur bond)

None

Non-standard residues

None

Content subtype: bmr6515_3.str

#	Content subtype	Saveframe	Status	# of rows	Experiment type	Sequence coverage (%)
1	Assigned chemical shifts	chem_shift_list_1	Warning	1739		96.6 (chain: 1, length: 174)
1	Chemical shift references	chemical_shift_referencing	OK	3		No information

Assigned chemical shifts

Saveframe: chem_shift_list_1
- Status: Warning
- Sequence coverage of experimental data
  - Entity_assembly_ID: 1, Chain length: 174, Sequence coverage: 96.6%
- Total number of assignments
  - ¹H chemical shifts: 937
  - ¹³C chemical shifts: 638
  - ¹⁵N chemical shifts: 164
- Completeness of assignments
  - Entity_assemble_ID: 1
- Redox state of CYS
- Peptide bond of PRO
- Rotameric state of ILE , LEU, and VAL
- Histogram of normalized assigned chemical shifts
- Random coil index and derived parameters (S² and NMR RMSD)
  - Chain_ID: 1