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BMRB: 25827

2N7Y

Backbone 1H, 13C, and 15N chemical shift assignments for metal-binding domain 1 of ATP7B

Authors

Yu, C., Lee, W., Dmitriev, O.

Assembly

metal-binding domain 1 of ATP7B

Entity

1. metal-binding domain 1 of ATP7B (polymer, Thiol state: all free), 76 monomers, 8114.397 Da Detail

AGHMQVATST VRILGMTCQS CVKSIEDRIS NLKGIISMKV SLEQGSATVK YVPSVVCLQQ VCHQIGDMGF EASIAE

Formula weight

8114.397 Da

Source organism

Homo sapiens

Exptl. method

solution NMR

Refine. method

simulated annealing

Data set

assigned_chemical_shifts

Chem. Shift Complete

Sequence coverage: 100.0 %, Completeness: 83.4 %, Completeness (bb): 96.7 % Detail

Polymer type: polypeptide(L)

	Total	¹H	¹³C	¹⁵N
All	83.4 % (700 of 839)	77.3 % (333 of 431)	89.9 % (293 of 326)	90.2 % (74 of 82)
Backbone	96.7 % (439 of 454)	94.9 % (149 of 157)	97.7 % (217 of 222)	97.3 % (73 of 75)
Sidechain	72.3 % (329 of 455)	67.2 % (184 of 274)	82.8 % (144 of 174)	14.3 % (1 of 7)
Aromatic	26.9 % (7 of 26)	53.8 % (7 of 13)	0.0 % (0 of 13)
Methyl	85.7 % (84 of 98)	87.8 % (43 of 49)	83.7 % (41 of 49)

1. entity

AGHMQVATST VRILGMTCQS CVKSIEDRIS NLKGIISMKV SLEQGSATVK YVPSVVCLQQ VCHQIGDMGF EASIAE

Show sample condition

Sample

Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 7.4

#	Name	Isotope labeling	Concentration
1	entity	[U-13C; U-15N]	0.5 mM
2	HEPES	natural abundance	50 mM
3	DSS	natural abundance	0.5 mM
4	TCEP	natural abundance	5 mM
5	D2O	natural abundance	10 %

LACS Plot; CA

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

Referencing offset: -0.44 ppm, Outliers: 2 Detail

LACS Plot; CB

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

Referencing offset: -0.44 ppm, Outliers: 2 Detail

LACS Plot; HA

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

Referencing offset: -0.1 ppm, Outliers: 1 Detail

LACS Plot; CO

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

Referencing offset: 0.3 ppm, Outliers: 1 Detail

Protein Blocks Logo

Calculated from 20 models in PDB: 2N7Y, Strand ID: A Detail

Release date

2016-03-27

Citation

Metal-binding domain 1 of ATP7B
Yu, C., Lee, W., Dmitriev, O., Yu, C., Lee, W., Dmitriev, O.
Not known

Related entities 1. metal-binding domain 1 of ATP7B, : 1 : 2 : 257 entities Detail

Interaction partners 1. metal-binding domain 1 of ATP7B, : 2 interactors Detail

More details for 2 interactors identified by 1 citations

Experiments performed 11 experiments Detail

1 2D 1H-15N HSQC