BMRBj - BMREntryMaster

Found 1 Document (0.55 seconds)

BMRB: 30871

7LVG

Jug r 2 Leader Sequence Residues 69-111

Authors

Mueller, G.A., Foo, A.C.Y., DeRose, E.F.

Assembly

Vicilin Jug r 2.0101

Entity

1. Vicilin Jug r 2.0101 (polymer, Thiol state: all disulfide bound), 45 monomers, 5807.321 Da Detail

GMPRDPEQRY EQCQQQCERQ RRGQEQTLCR RRCEQRRQQE ERERQ

Formula weight

5807.321 Da

Entity Connection

disulfide 2 Detail

ID	Type	Value order	Atom ID 1	Atom ID 2
1	disulfide	sing	1:CYS13:SG	1:CYS33:SG
2	disulfide	sing	1:CYS17:SG	1:CYS29:SG

Source organism

Exptl. method

Data set

assigned_chemical_shifts, spectral_peak_list

Chem. Shift Complete

Sequence coverage: 93.3 %, Completeness: 61.8 %, Completeness (bb): 75.2 % Detail

Polymer type: polypeptide(L)

	Total	¹H	¹³C	¹⁵N
All	61.8 % (356 of 576)	57.9 % (184 of 318)	69.6 % (133 of 191)	58.2 % (39 of 67)
Backbone	75.2 % (200 of 266)	87.8 % (79 of 90)	62.4 % (83 of 133)	88.4 % (38 of 43)
Sidechain	55.5 % (196 of 353)	46.1 % (105 of 228)	89.1 % (90 of 101)	4.2 % (1 of 24)
Aromatic	100.0 % (8 of 8)	100.0 % (4 of 4)	100.0 % (4 of 4)
Methyl	100.0 % (6 of 6)	100.0 % (3 of 3)	100.0 % (3 of 3)

1. entity 1

GMPRDPEQRY EQCQQQCERQ RRGQEQTLCR RRCEQRRQQE ERERQ

Show sample condition

Sample

Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298.15 K, pH 7.4, Details 50 uM Sodium trimethylsilylpropanesulfonate (DSS), 90% H2O/10% D2O

#	Name	Isotope labeling	Type	Concentration
1	entity_1			0.0 ~ 0.0 mM
2	Sodium trimethylsilylpropanesulfonate (DSS)	natural abundance		50 uM

Release date

2021-03-25

Citation

Structure, Immunogenicity, and IgE Cross-Reactivity among Walnut and Peanut Vicilin-Buried Peptides
Foo, A., Nesbit, J.B., Gipson, S., Cheng, H., Bushel, P., DeRose, E.F., Schein, C.H., Teuber, S.S., Hurlburt, B.K., Maleki, S.J., Mueller, G.A.
J. Agric. Food Chem. (2022), 70, 2389-2400, PubMed 35139305 , DOI 10.1021/acs.jafc.1c07225 , Abstract

Related entities 1. Vicilin Jug r 2.0101, : 4 entities Detail

Experiments performed 10 experiments Detail

1 3D NOESY

Instrument

Varian INOVA - 800 MHz

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298.15 K, pH 7.4, Details 50 uM Sodium trimethylsilylpropanesulfonate (DSS), 90% H2O/10% D2O

#	Name	Isotope labeling	Type	Concentration
1	entity_1			0.0 ~ 0.0 mM
2	Sodium trimethylsilylpropanesulfonate (DSS)	natural abundance		50 uM

2 3D NOESY

Instrument

Varian INOVA - 800 MHz

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298.15 K, pH 7.4, Details 50 uM Sodium trimethylsilylpropanesulfonate (DSS), 90% H2O/10% D2O

#	Name	Isotope labeling	Type	Concentration
1	entity_1			0.0 ~ 0.0 mM
2	Sodium trimethylsilylpropanesulfonate (DSS)	natural abundance		50 uM

3 2D 1H-13C HSQC aliphatic

Instrument

Varian INOVA - 600 MHz

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298.15 K, pH 7.4, Details 50 uM Sodium trimethylsilylpropanesulfonate (DSS), 90% H2O/10% D2O

#	Name	Isotope labeling	Type	Concentration
1	entity_1			0.0 ~ 0.0 mM
2	Sodium trimethylsilylpropanesulfonate (DSS)	natural abundance		50 uM

4 2D 1H-13C HSQC aromatic

Instrument

Varian INOVA - 600 MHz

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298.15 K, pH 7.4, Details 50 uM Sodium trimethylsilylpropanesulfonate (DSS), 90% H2O/10% D2O

#	Name	Isotope labeling	Type	Concentration
1	entity_1			0.0 ~ 0.0 mM
2	Sodium trimethylsilylpropanesulfonate (DSS)	natural abundance		50 uM

5 2D 1H-15N HSQC

Instrument

Varian INOVA - 600 MHz

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298.15 K, pH 7.4, Details 50 uM Sodium trimethylsilylpropanesulfonate (DSS), 90% H2O/10% D2O

#	Name	Isotope labeling	Type	Concentration
1	entity_1			0.0 ~ 0.0 mM
2	Sodium trimethylsilylpropanesulfonate (DSS)	natural abundance		50 uM

6 3D C(CO)NH

Instrument

Varian INOVA - 600 MHz

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298.15 K, pH 7.4, Details 50 uM Sodium trimethylsilylpropanesulfonate (DSS), 90% H2O/10% D2O

#	Name	Isotope labeling	Type	Concentration
1	entity_1			0.0 ~ 0.0 mM
2	Sodium trimethylsilylpropanesulfonate (DSS)	natural abundance		50 uM

7 3D CBCA(CO)NH

Instrument

Varian INOVA - 600 MHz

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298.15 K, pH 7.4, Details 50 uM Sodium trimethylsilylpropanesulfonate (DSS), 90% H2O/10% D2O

#	Name	Isotope labeling	Type	Concentration
1	entity_1			0.0 ~ 0.0 mM
2	Sodium trimethylsilylpropanesulfonate (DSS)	natural abundance		50 uM

8 3D HNCO

Instrument

Varian INOVA - 600 MHz

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298.15 K, pH 7.4, Details 50 uM Sodium trimethylsilylpropanesulfonate (DSS), 90% H2O/10% D2O

#	Name	Isotope labeling	Type	Concentration
1	entity_1			0.0 ~ 0.0 mM
2	Sodium trimethylsilylpropanesulfonate (DSS)	natural abundance		50 uM

9 3D HNCACB

Instrument

Varian INOVA - 600 MHz

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298.15 K, pH 7.4, Details 50 uM Sodium trimethylsilylpropanesulfonate (DSS), 90% H2O/10% D2O

#	Name	Isotope labeling	Type	Concentration
1	entity_1			0.0 ~ 0.0 mM
2	Sodium trimethylsilylpropanesulfonate (DSS)	natural abundance		50 uM

10 3D H(CCO)NH

Instrument

Varian INOVA - 600 MHz

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298.15 K, pH 7.4, Details 50 uM Sodium trimethylsilylpropanesulfonate (DSS), 90% H2O/10% D2O

#	Name	Isotope labeling	Type	Concentration
1	entity_1			0.0 ~ 0.0 mM
2	Sodium trimethylsilylpropanesulfonate (DSS)	natural abundance		50 uM

nullKeywords ALLERGEN, Seed storage