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BMRB: 6272

1Z9V

NMR ASSIGNMENT OF MTH0776 FROM METHANOBACTERIUM THERMOAUTOTROPHICUM STRAIN H

Authors

AMEGBEY, G.YAO., ZHAN, C., YEE, A., ARROWSMITH, C., WISHART, D.S.

Assembly

MTH0776

Entity

1. MTH0776 (polymer, Thiol state: all free), 121 monomers, 13560.54 Da Detail

MGSSHHHHHH SSGLVPRGSH MTFCLETYLQ QSGEYEIHMK RAGFRECAAM IEKKARRVVH IKPGEKILGA RIIGIPPVPI GIDEERSTVM IPYTKPCYGT AVVELPVDPE EIERILEVAE P

Formula weight

13560.54 Da

Source organism

Methanothermobacter thermautotrophicus

Exptl. method

Refine. method

simulated annealing protocol in XPLOR-NIH

Data set

assigned_chemical_shifts

Chem. Shift Complete

Sequence coverage: 99.2 %, Completeness: 92.0 %, Completeness (bb): 96.5 % Detail

Polymer type: polypeptide(L)

	Total	¹H	¹³C	¹⁵N
All	92.0 % (1286 of 1398)	95.9 % (701 of 731)	85.7 % (475 of 554)	97.3 % (110 of 113)
Backbone	96.5 % (681 of 706)	98.3 % (238 of 242)	94.9 % (335 of 353)	97.3 % (108 of 111)
Sidechain	88.7 % (712 of 803)	94.7 % (463 of 489)	79.2 % (247 of 312)	100.0 % (2 of 2)
Aromatic	72.7 % (64 of 88)	77.3 % (34 of 44)	68.2 % (30 of 44)
Methyl	87.9 % (116 of 132)	100.0 % (66 of 66)	75.8 % (50 of 66)

1. MTH0776

MGSSHHHHHH SSGLVPRGSH MTFCLETYLQ QSGEYEIHMK RAGFRECAAM IEKKARRVVH IKPGEKILGA RIIGIPPVPI GIDEERSTVM IPYTKPCYGT AVVELPVDPE EIERILEVAE P

Show sample condition

Sample

Temperature 298 K, pH 6.8 (±0.1)

#	Name	Isotope labeling	Type	Concentration
1	MTH0776	[U-100% 13C; U-100% 15N]		1 mM
2	NaH2PO4			50 mM
3	NaCL			300 mM
4	DTT			15 mM
5	NaN3			0.06 %
6	DSS			0.1 mM

LACS Plot; CA

Referencing offset: -0.18 ppm, Outliers: 1 Detail

LACS Plot; CB

Referencing offset: -0.18 ppm, Outliers: 1 Detail

LACS Plot; HA

Referencing offset: -0.1 ppm, Outliers: 4 Detail

LACS Plot; CO

Referencing offset: -0.15 ppm, Outliers: 1 Detail

Protein Blocks Logo

Calculated from 20 models in PDB: 1Z9V, Strand ID: A Detail

Release date

2005-10-27

Citation 1

Complete 1H, 13C and 15N NMR assignments of MTH0776 from Methanobacterium thermoautotrophicum
AMEGBEY, G.Y., CHANG, Z., STOTHARD, P., YEE, A., ARROWSMITH, C., WISHART, D.S.
J. Biomol. NMR (2004), 30, 459-460, PubMed 15630567 , DOI 10.1007/s10858-004-4341-5 , Abstract

Show more 1 citaion

Citation 2

Solution Structure of MTH0776 from Methanobacterium thermoautotrophicum
AMEGBEY, G., STOTHARD, P., KUZNETSOVA, E., YEE, A., ARROWSMITH, C.H., WISHART, D.S.
J. Biomol. NMR (2005), 33, 51-56, PubMed 16222557 , DOI 10.1007/s10858-005-1275-5 , Abstract

Hide non-primary 1 citaion

Related entities 1. MTH0776, : 1 : 1 entities Detail

Experiments performed 13 experiments Detail

1 2D 15N HSQC

Instrument

Varian INOVA - 500 MHz

Sample

State isotropic, Temperature 298 K, pH 6.8 (±0.1)

#	Name	Isotope labeling	Type	Concentration
1	MTH0776	[U-100% 13C; U-100% 15N]		1 mM
2	NaH2PO4			50 mM
3	NaCL			300 mM
4	DTT			15 mM
5	NaN3			0.06 %
6	DSS			0.1 mM

2 2D 13C HSQC

Instrument

Varian INOVA - 500 MHz

Sample

State isotropic, Temperature 298 K, pH 6.8 (±0.1)

#	Name	Isotope labeling	Type	Concentration
1	MTH0776	[U-100% 13C; U-100% 15N]		1 mM
2	NaH2PO4			50 mM
3	NaCL			300 mM
4	DTT			15 mM
5	NaN3			0.06 %
6	DSS			0.1 mM

3 2D 1H-1H NOESY

Instrument

Varian INOVA - 500 MHz

Sample

State isotropic, Temperature 298 K, pH 6.8 (±0.1)

#	Name	Isotope labeling	Type	Concentration
1	MTH0776	[U-100% 13C; U-100% 15N]		1 mM
2	NaH2PO4			50 mM
3	NaCL			300 mM
4	DTT			15 mM
5	NaN3			0.06 %
6	DSS			0.1 mM

4 3D HNCACB

Instrument

Varian INOVA - 500 MHz

Sample

State isotropic, Temperature 298 K, pH 6.8 (±0.1)

#	Name	Isotope labeling	Type	Concentration
1	MTH0776	[U-100% 13C; U-100% 15N]		1 mM
2	NaH2PO4			50 mM
3	NaCL			300 mM
4	DTT			15 mM
5	NaN3			0.06 %
6	DSS			0.1 mM

5 HNCA

Instrument

Varian INOVA - 500 MHz

Sample

State isotropic, Temperature 298 K, pH 6.8 (±0.1)

#	Name	Isotope labeling	Type	Concentration
1	MTH0776	[U-100% 13C; U-100% 15N]		1 mM
2	NaH2PO4			50 mM
3	NaCL			300 mM
4	DTT			15 mM
5	NaN3			0.06 %
6	DSS			0.1 mM

6 CBCA (CO) NH

Instrument

Varian INOVA - 500 MHz

Sample

State isotropic, Temperature 298 K, pH 6.8 (±0.1)

#	Name	Isotope labeling	Type	Concentration
1	MTH0776	[U-100% 13C; U-100% 15N]		1 mM
2	NaH2PO4			50 mM
3	NaCL			300 mM
4	DTT			15 mM
5	NaN3			0.06 %
6	DSS			0.1 mM

7 HNCO

Instrument

Varian INOVA - 500 MHz

Sample

State isotropic, Temperature 298 K, pH 6.8 (±0.1)

#	Name	Isotope labeling	Type	Concentration
1	MTH0776	[U-100% 13C; U-100% 15N]		1 mM
2	NaH2PO4			50 mM
3	NaCL			300 mM
4	DTT			15 mM
5	NaN3			0.06 %
6	DSS			0.1 mM

8 HNHA

Instrument

Varian INOVA - 500 MHz

Sample

State isotropic, Temperature 298 K, pH 6.8 (±0.1)

#	Name	Isotope labeling	Type	Concentration
1	MTH0776	[U-100% 13C; U-100% 15N]		1 mM
2	NaH2PO4			50 mM
3	NaCL			300 mM
4	DTT			15 mM
5	NaN3			0.06 %
6	DSS			0.1 mM

9 3D H (CCO) NH

Instrument

Varian INOVA - 500 MHz

Sample

State isotropic, Temperature 298 K, pH 6.8 (±0.1)

#	Name	Isotope labeling	Type	Concentration
1	MTH0776	[U-100% 13C; U-100% 15N]		1 mM
2	NaH2PO4			50 mM
3	NaCL			300 mM
4	DTT			15 mM
5	NaN3			0.06 %
6	DSS			0.1 mM

10 C (CO) NH

Instrument

Varian INOVA - 500 MHz

Sample

State isotropic, Temperature 298 K, pH 6.8 (±0.1)

#	Name	Isotope labeling	Type	Concentration
1	MTH0776	[U-100% 13C; U-100% 15N]		1 mM
2	NaH2PO4			50 mM
3	NaCL			300 mM
4	DTT			15 mM
5	NaN3			0.06 %
6	DSS			0.1 mM

11 DE-H (C) CH-TOCSY

Instrument

Varian INOVA - 500 MHz

Sample

State isotropic, Temperature 298 K, pH 6.8 (±0.1)

#	Name	Isotope labeling	Type	Concentration
1	MTH0776	[U-100% 13C; U-100% 15N]		1 mM
2	NaH2PO4			50 mM
3	NaCL			300 mM
4	DTT			15 mM
5	NaN3			0.06 %
6	DSS			0.1 mM

12 3D 1H-15N NOESY

Instrument

Varian INOVA - 500 MHz

Sample

State isotropic, Temperature 298 K, pH 6.8 (±0.1)

#	Name	Isotope labeling	Type	Concentration
1	MTH0776	[U-100% 13C; U-100% 15N]		1 mM
2	NaH2PO4			50 mM
3	NaCL			300 mM
4	DTT			15 mM
5	NaN3			0.06 %
6	DSS			0.1 mM

13 13C NOESY

Instrument

Varian INOVA - 500 MHz

Sample

State isotropic, Temperature 298 K, pH 6.8 (±0.1)

#	Name	Isotope labeling	Type	Concentration
1	MTH0776	[U-100% 13C; U-100% 15N]		1 mM
2	NaH2PO4			50 mM
3	NaCL			300 mM
4	DTT			15 mM
5	NaN3			0.06 %
6	DSS			0.1 mM

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