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BMRB: 16336

2KJQ

Solution Structure Of Protein NMB1076 From Neisseria meningitidis. Northeast Structural Genomics Consortium Target MR101B.

Authors

Wu, Y., Maglaqui, M., Eletsky, A., Ciccosanti, C., Sathyamoorthy, B., Jiang, M., Garcia, E., Nair, R., Rost, B., Swapna, G., Acton, T., Xiao, R., Everett, J., Montelione, G., Szyperski, T.

Assembly

NMB1076

Entity

1. NMB1076 (polymer, Thiol state: all free), 149 monomers, 16978.98 Da Detail

MGHHHHHHSH MDYPSFDKFL GTENAELVYV LRHKHGQFIY VWGEEGAGKS HLLQAWVAQA LEAGKNAAYI DAASMPLTDA AFEAEYLAVD QVEKLGNEEQ ALLFSIFNRF RNSGKGFLLL GSEYTPQQLV IREDLRTRMA YCLVYEVKP

Formula weight

16978.98 Da

Source organism

Neisseria meningitidis

Exptl. method

solution NMR

Refine. method

simulated annealing

Data set

assigned_chemical_shifts, spectral_peak_list

Chem. Shift Complete

Sequence coverage: 84.6 %, Completeness: 72.8 %, Completeness (bb): 70.5 % Detail

Polymer type: polypeptide(L)

	Total	¹H	¹³C	¹⁵N
All	72.8 % (1279 of 1756)	78.9 % (714 of 905)	62.7 % (434 of 692)	82.4 % (131 of 159)
Backbone	70.5 % (625 of 886)	81.3 % (248 of 305)	59.6 % (260 of 436)	80.7 % (117 of 145)
Sidechain	76.3 % (769 of 1008)	77.7 % (466 of 600)	73.4 % (289 of 394)	100.0 % (14 of 14)
Aromatic	57.2 % (119 of 208)	69.2 % (72 of 104)	44.1 % (45 of 102)	100.0 % (2 of 2)
Methyl	100.0 % (160 of 160)	100.0 % (80 of 80)	100.0 % (80 of 80)

1. NMB1076

MGHHHHHHSH MDYPSFDKFL GTENAELVYV LRHKHGQFIY VWGEEGAGKS HLLQAWVAQA LEAGKNAAYI DAASMPLTDA AFEAEYLAVD QVEKLGNEEQ ALLFSIFNRF RNSGKGFLLL GSEYTPQQLV IREDLRTRMA YCLVYEVKP

Show sample condition

Sample #1

Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 6.5

#	Name	Isotope labeling	Concentration
1	entity	[U-100% 13C; U-100% 15N]	1.0 mM
2	H2O	natural abundance	90 %
3	D2O	natural abundance	10 %

Sample #2

Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 6.5

#	Name	Isotope labeling	Concentration
4	entity	[U-5% 13C; U-100% 15N]	1.0 mM
5	H2O	natural abundance	90 %
6	D2O	natural abundance	10 %

LACS Plot; CA

Atom type	Mol. common name	Atom group	Ref. method	Ref. type	Shift ratio
¹³C	DSS	methyl protons	null	indirect	0.2514495
¹H	DSS	methyl protons	internal	direct	1.0
¹⁵N	DSS	methyl protons	null	indirect	0.1013291

Referencing offset: 0.07 ppm, Outliers: 1 Detail

LACS Plot; CB

Atom type	Mol. common name	Atom group	Ref. method	Ref. type	Shift ratio
¹³C	DSS	methyl protons	null	indirect	0.2514495
¹H	DSS	methyl protons	internal	direct	1.0
¹⁵N	DSS	methyl protons	null	indirect	0.1013291

Referencing offset: 0.07 ppm, Outliers: 1 Detail

LACS Plot; HA

Atom type	Mol. common name	Atom group	Ref. method	Ref. type	Shift ratio
¹³C	DSS	methyl protons	null	indirect	0.2514495
¹H	DSS	methyl protons	internal	direct	1.0
¹⁵N	DSS	methyl protons	null	indirect	0.1013291

Referencing offset: -0.02 ppm, Outliers: 4 Detail

Protein Blocks Logo

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

Release date

2009-07-06

Citation

Solution Structure Of Protein NMB1076 From Neisseria meningitidis. Northeast Structural Genomics Consortium Target MR101B
Wu, Y., Maglaqui, M., Eletsky, A., Ciccosanti, C., Sathyamoorthy, B., Jiang, M., Garcia, E., Nair, R., Rost, B., Swapna, G., Acton, T., Xiao, R., Everett, J., Montelione, G., Szyperski, T.
Not known

Related entities 1. NMB1076, : 1 : 29 entities Detail

Experiments performed 8 experiments Detail

1 2D 1H-15N HSQC