BMRBj - BMREntryMaster

Found 1 Document (0.556 seconds)

BMRB: 30870

7LVF

Jug R 2 Leader Sequence Residues 1-57

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), 57 monomers, 7202.576 Da Detail

MRGRDDDDEE NPRDPREQYR QCQEYCRRQG QGQRQQQQCQ IRCEERLEED QRSQEER

Formula weight

7202.576 Da

Entity Connection

disulfide 2 Detail

ID	Type	Value order	Atom ID 1	Atom ID 2
1	disulfide	sing	1:CYS22:SG	1:CYS43:SG
2	disulfide	sing	1:CYS26:SG	1:CYS39:SG

Source organism

Exptl. method

Data set

assigned_chemical_shifts, spectral_peak_list

Chem. Shift Complete

Sequence coverage: 100.0 %, Completeness: 66.0 %, Completeness (bb): 82.2 % Detail

Polymer type: polypeptide(L)

	Total	¹H	¹³C	¹⁵N
All	66.0 % (461 of 698)	60.7 % (232 of 382)	74.5 % (175 of 235)	66.7 % (54 of 81)
Backbone	82.2 % (278 of 338)	94.8 % (109 of 115)	68.5 % (115 of 168)	98.2 % (54 of 55)
Sidechain	57.0 % (236 of 414)	46.1 % (123 of 267)	93.4 % (113 of 121)	0.0 % (0 of 26)
Aromatic	75.0 % (12 of 16)	75.0 % (6 of 8)	75.0 % (6 of 8)
Methyl	75.0 % (6 of 8)	75.0 % (3 of 4)	75.0 % (3 of 4)

1. entity 1

MRGRDDDDEE NPRDPREQYR QCQEYCRRQG QGQRQQQQCQ IRCEERLEED QRSQEER

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, 90% H2O/10% D2O

#	Name	Isotope labeling	Type	Concentration
1	entity_1			0.0 ~ 0.0 mM
2	Sodium trimethylsilylpropanesulfonate	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

Experiments performed 10 experiments Detail

1 3D 1H-15N 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, 90% H2O/10% D2O

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

2 3D 1H-13C 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, 90% H2O/10% D2O

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

3 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, 90% H2O/10% D2O

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

4 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, 90% H2O/10% D2O

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

5 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, 90% H2O/10% D2O

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

6 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, 90% H2O/10% D2O

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

7 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, 90% H2O/10% D2O

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

8 2D 1H-15N HSQC

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, 90% H2O/10% D2O

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

9 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, 90% H2O/10% D2O

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

10 2D 1H-13C HSQC aromatic

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, 90% H2O/10% D2O

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

nullKeywords ALLERGEN, Seed storage