BMRB: 16539

Solution structure of nasonin-1

Authors

Kouno, T., Tian, C., Luo, L., Zhu, S., Mizuguchi, M.

Assembly

nasonin-1

Entity

1. nasonin-1 (polymer, Thiol state: all disulfide bound), 33 monomers, 3561.002 Da Detail

ACNDRDCSLD CIMKGYNTGS CVRGSCQCRR TSG

Formula weight

3561.002 Da

Entity Connection

disulfide 3 Detail

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ID	Type	Value order	Atom ID 1	Atom ID 2
1	disulfide	sing	1:CYS2:SG	1:CYS21:SG
2	disulfide	sing	1:CYS7:SG	1:CYS26:SG
3	disulfide	sing	1:CYS11:SG	1:CYS28:SG

Exptl. method

solution NMR

Refine. method

simulated annealing

Data set

assigned_chemical_shifts

Chem. Shift Complete

Sequence coverage: 100.0 %, Completeness: 96.0 %, Completeness (bb): 100.0 % Detail

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Polymer type: polypeptide(L)

	Total	1H
All	96.0 % (168 of 175)	96.0 % (168 of 175)
Backbone	100.0 % (70 of 70)	100.0 % (70 of 70)
Sidechain	93.3 % (98 of 105)	93.3 % (98 of 105)
Aromatic	100.0 % (4 of 4)	100.0 % (4 of 4)
Methyl	100.0 % (9 of 9)	100.0 % (9 of 9)

1. nasonin-1

ACNDRDCSLD CIMKGYNTGS CVRGSCQCRR TSG

Show sample condition

Sample #1

Solvent system 95% H2O/5% D2O, Pressure 1 atm, Temperature 298 K, pH 3.5

#	Name	Isotope labeling	Type	Concentration
1	Nasonin-1	natural abundance		0.25 ~ 0.3 mM
2	acetic acid	[U-100% 2H]		50 mM
3	sodium chloride	natural abundance		20 mM
4	D2O	[U-100% 2H]		5 %
5	H2O	natural abundance		95 %

Sample #2

Solvent system 100% D2O, Pressure 1 atm, Temperature 298 K, pH 3.5

#	Name	Isotope labeling	Type	Concentration
6	Nasonin-1	natural abundance		0.25 ~ 0.3 mM
7	acetic acid	[U-100% 2H]		50 mM
8	sodium chloride	natural abundance		20 mM
9	D2O	[U-100% 2H]		100 %

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Calculated from 25 models in PDB: 2KOZ, Strand ID: A Detail

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Release date

2012-08-02

Citation

Not known
Tian, C., Kouno, T., Luo, L., Mizuguchi, M., Zhu, S.
Not known

Related entities 1. nasonin-1, : 1 : 1 : 23 entities Detail

Experiments performed 6 experiments Detail