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BMRB: 16371

2KKS

Solution Structure Of Protein DSY2949 From Desulfitobacterium hafniense. Northeast Structural Genomics Consortium Target DhR27

Authors

Wu, Y., Mills, J., Wang, H., Ciccosanti, C., Jiang, M., Sukumaran, D., Zhang, Q., Nair, R., Rost, B., Acton, T., Xiao, R., Swapna, G., Everett, J., Montelione, G., Szyperski, T.

Assembly

DSY2949

Entity

1. DSY2949 (polymer, Thiol state: all free), 146 monomers, 16793.92 Da Detail

MITLTKKQME EMLAHARQAL PNEACGLLGG RRDGDDRWVE RVYPLNNLDQ SPEHFSMDPR EQLTAVKDMR KNGWVMLGNF HSHPATPARP SAEDKRLAFD PSLSYLIISL AEPQKPVCKS FLIKKDGVDE EEIILKEELE HHHHHH

Formula weight

16793.92 Da

Source organism

Desulfitobacterium hafniense

Exptl. method

solution NMR

Refine. method

simulated annealing

Data set

assigned_chemical_shifts, spectral_peak_list

Chem. Shift Complete

Sequence coverage: 97.3 %, Completeness: 88.1 %, Completeness (bb): 83.1 % Detail

Polymer type: polypeptide(L)

	Total	¹H	¹³C	¹⁵N
All	88.1 % (1522 of 1728)	94.9 % (864 of 910)	76.9 % (515 of 670)	96.6 % (143 of 148)
Backbone	83.1 % (711 of 856)	96.2 % (278 of 289)	70.1 % (302 of 431)	96.3 % (131 of 136)
Sidechain	93.4 % (944 of 1011)	94.4 % (586 of 621)	91.5 % (346 of 378)	100.0 % (12 of 12)
Aromatic	66.7 % (80 of 120)	76.7 % (46 of 60)	55.2 % (32 of 58)	100.0 % (2 of 2)
Methyl	100.0 % (140 of 140)	100.0 % (70 of 70)	100.0 % (70 of 70)

1. DSY2949

MITLTKKQME EMLAHARQAL PNEACGLLGG RRDGDDRWVE RVYPLNNLDQ SPEHFSMDPR EQLTAVKDMR KNGWVMLGNF HSHPATPARP SAEDKRLAFD PSLSYLIISL AEPQKPVCKS FLIKKDGVDE EEIILKEELE HHHHHH

Show sample condition

Sample #1

Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 4.5

#	Name	Isotope labeling	Concentration
1	entity	[U-100% 13C; U-100% 15N]	0.9 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 4.5

#	Name	Isotope labeling	Concentration
4	entity	[U-10% 13C; U-100% 15N]	0.9 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: 0.31 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: 0.31 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: 3 Detail

Protein Blocks Logo

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

Release date

2009-08-05

Citation

Solution Structure Of Protein DSY2949 From Desulfitobacterium hafniense. Northeast Structural Genomics Consortium Target DhR27
Wu, Y., Mills, J., Wang, H., Ciccosanti, C., Jiang, M., Sukumaran, D., Zhang, Q., Nair, R., Rost, B., Acton, T., Xiao, R., Swapna, G., Everett, J., Montelione, G., Szyperski, T.
Not known

Related entities 1. DSY2949, : 1 : 5 entities Detail

Experiments performed 8 experiments Detail

1 2D 1H-15N HSQC