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BMRB: 5790

1NWB

Solution structure of the Hypothetical protein AQ_1857 from Aquifex aeolicus: Northeast Structural Genomics Consortium Target QR6

Authors: Xu, D., Liu, G., Xiao, R., Acton, T., Montelione, G.T., Szyperski, T.
Assembly: Hypothetical protein AQ 1857
Entity: 1. Hypothetical protein AQ 1857 (polymer, Thiol state: all free), 124 monomers, 13725.16 Da Detail
MQEQAQQFIF KVTDKAVEEI KKVAQENNIE NPILRIRVVP GGCSGFQYAM GFDDTVEEGD HVFEYDGVKV VIDPFSMPYV NGAELDYVVD FMGGGFTIRN PNATGSCGCG SSFSCGLEHH HHHH
Formula weight: 13725.16 Da
Source organism: Aquifex aeolicus
Exptl. method: NMR
Refine. method: distance geometry
Data set: coupling_constants
Protein Blocks Logo: Calculated from 20 models in PDB: 1NWB, Strand ID: A Detail
Coupling constant: 50 J values in 1 lists
Pressure 1 atm, Temperature 293 K, pH 6.5 Detail
Pressure 1 atm, Temperature 293 K, pH 6.5
List #1 coupling_constants_1
Release date: 2004-03-14
Citation: NMR structure of the hypothetical protein AQ-1857 encoded by the Y157 gene from Aquifex aeolicus reveals a novel protein fold
Xu, D., Liu, G., Xiao, R., Acton, T., Goldsmith-Fischman, S., Honig, B., Montelione, G.T., Szyperski, T.
Proteins (2004), 54, 794-796, PubMed 14997575 , DOI 10.1002/prot.10424 , Abstract

Entries sharing articles BMRB: 1, Swiss-Prot: 1 entries Detail

  BMRB: 5683 released on 2004-09-13
    Title QR6 structure
  Swiss-Prot: O67709 released on 2000-05-30
    Title Y1857_AQUAE Entity Protein aq_1857

Related entities 1. Hypothetical protein AQ 1857, : 1 : 1 : 147 entities Detail

Experiments performed 7 experiments Detail

1 3D 13C-separated NOESY

Instrument

Model Varian INOVA (750 MHz)

Sample #1

Pressure 1 atm, Temperature 293 K, pH 6.5

#	Name	Isotope labeling	Type	Concentration
1	Hypothetical protein AQ_1857	[U-15N; U-13C]		1.08 mM
2	MES			20 mM
3	NaCl			50 mM
4	DTT			5 mM
5	D2O			5 %
6	NaN3			0.02 %

Sample #2

Pressure 1 atm, Temperature 293 K, pH 6.5

#	Name	Isotope labeling	Type	Concentration
7	Hypothetical protein AQ_1857	[U-15N; U-5% 13C]		1.01 mM
8	MES			20 mM
9	NaCl			100 mM
10	DTT			10 mM
11	D2O			5 %
12	NaN3			0.02 %

2 3D 15N-separated NOESY

Instrument

Model Varian INOVA (750 MHz)

Sample #1

Pressure 1 atm, Temperature 293 K, pH 6.5

#	Name	Isotope labeling	Type	Concentration
1	Hypothetical protein AQ_1857	[U-15N; U-13C]		1.08 mM
2	MES			20 mM
3	NaCl			50 mM
4	DTT			5 mM
5	D2O			5 %
6	NaN3			0.02 %

Sample #2

Pressure 1 atm, Temperature 293 K, pH 6.5

#	Name	Isotope labeling	Type	Concentration
7	Hypothetical protein AQ_1857	[U-15N; U-5% 13C]		1.01 mM
8	MES			20 mM
9	NaCl			100 mM
10	DTT			10 mM
11	D2O			5 %
12	NaN3			0.02 %

3 HNHA

Instrument

Model Varian INOVA (750 MHz)

Sample #1

Pressure 1 atm, Temperature 293 K, pH 6.5

#	Name	Isotope labeling	Type	Concentration
1	Hypothetical protein AQ_1857	[U-15N; U-13C]		1.08 mM
2	MES			20 mM
3	NaCl			50 mM
4	DTT			5 mM
5	D2O			5 %
6	NaN3			0.02 %

Sample #2

Pressure 1 atm, Temperature 293 K, pH 6.5

#	Name	Isotope labeling	Type	Concentration
7	Hypothetical protein AQ_1857	[U-15N; U-5% 13C]		1.01 mM
8	MES			20 mM
9	NaCl			100 mM
10	DTT			10 mM
11	D2O			5 %
12	NaN3			0.02 %

4 ct-13C-HSQC

Instrument

Model Varian INOVA (750 MHz)

Sample #1

Pressure 1 atm, Temperature 293 K, pH 6.5

#	Name	Isotope labeling	Type	Concentration
1	Hypothetical protein AQ_1857	[U-15N; U-13C]		1.08 mM
2	MES			20 mM
3	NaCl			50 mM
4	DTT			5 mM
5	D2O			5 %
6	NaN3			0.02 %

Sample #2

Pressure 1 atm, Temperature 293 K, pH 6.5

#	Name	Isotope labeling	Type	Concentration
7	Hypothetical protein AQ_1857	[U-15N; U-5% 13C]		1.01 mM
8	MES			20 mM
9	NaCl			100 mM
10	DTT			10 mM
11	D2O			5 %
12	NaN3			0.02 %

5 3D-HNNCACB

Instrument

Model Varian INOVA (750 MHz)

Sample #1

Pressure 1 atm, Temperature 293 K, pH 6.5

#	Name	Isotope labeling	Type	Concentration
1	Hypothetical protein AQ_1857	[U-15N; U-13C]		1.08 mM
2	MES			20 mM
3	NaCl			50 mM
4	DTT			5 mM
5	D2O			5 %
6	NaN3			0.02 %

Sample #2

Pressure 1 atm, Temperature 293 K, pH 6.5

#	Name	Isotope labeling	Type	Concentration
7	Hypothetical protein AQ_1857	[U-15N; U-5% 13C]		1.01 mM
8	MES			20 mM
9	NaCl			100 mM
10	DTT			10 mM
11	D2O			5 %
12	NaN3			0.02 %

6 3D-RD-HABCABcoNHN

Instrument

Model Varian INOVA (750 MHz)

Sample #1

Pressure 1 atm, Temperature 293 K, pH 6.5

#	Name	Isotope labeling	Type	Concentration
1	Hypothetical protein AQ_1857	[U-15N; U-13C]		1.08 mM
2	MES			20 mM
3	NaCl			50 mM
4	DTT			5 mM
5	D2O			5 %
6	NaN3			0.02 %

Sample #2

Pressure 1 atm, Temperature 293 K, pH 6.5

#	Name	Isotope labeling	Type	Concentration
7	Hypothetical protein AQ_1857	[U-15N; U-5% 13C]		1.01 mM
8	MES			20 mM
9	NaCl			100 mM
10	DTT			10 mM
11	D2O			5 %
12	NaN3			0.02 %

7 3D-RD-HCCH-COSY

Instrument

Model Varian INOVA (750 MHz)

Sample #1

Pressure 1 atm, Temperature 293 K, pH 6.5

#	Name	Isotope labeling	Type	Concentration
1	Hypothetical protein AQ_1857	[U-15N; U-13C]		1.08 mM
2	MES			20 mM
3	NaCl			50 mM
4	DTT			5 mM
5	D2O			5 %
6	NaN3			0.02 %

Sample #2

Pressure 1 atm, Temperature 293 K, pH 6.5

#	Name	Isotope labeling	Type	Concentration
7	Hypothetical protein AQ_1857	[U-15N; U-5% 13C]		1.01 mM
8	MES			20 mM
9	NaCl			100 mM
10	DTT			10 mM
11	D2O			5 %
12	NaN3			0.02 %

nullKeywords QR6, structural genomics, Reduced Dimensionality NMR