BMRB: 15961

Backbone and Side chain 1H, 13C, and 15N Chemical Shift Assignments for Microneme protein 2 Associated protein

Authors

Liu, B., Sawmynaden, K., Simpson, P., Matthews, S.

Assembly

M2AP

Entity

1. M2AP (polymer, Thiol state: all disulfide bound), 182 monomers, 19325.45 Da Detail

TFLELVEVPC NSVHVQGVMT PNQMVKVTGA GWDNGVLEFY VTRPTKTGGD TSRSHLASIM CYSKDIDGVP SDKAGKCFLK NFSGEDSSEI DEKEVSLPIK SHNDAFMFVC SSNDGSALQC DVFALDNTNS SDGWKVNTVD LGVSVSPDLA FGLTADGVKV KKLYASSGLT AINDDPSLGC KA

Formula weight

19325.45 Da

Source organism

Escherichia coli

Exptl. method

solution NMR

Refine. method

simulated annealing, distance geometry

Data set

assigned_chemical_shifts

Chem. Shift Complete

Sequence coverage: 99.5 %, Completeness: 92.7 %, Completeness (bb): 97.1 % Detail

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Polymer type: polypeptide(L)

	Total	1H	13C	15N
All	92.7 % (1839 of 1983)	91.3 % (926 of 1014)	94.1 % (733 of 779)	94.7 % (180 of 190)
Backbone	97.1 % (1047 of 1078)	95.7 % (357 of 373)	98.3 % (521 of 530)	96.6 % (169 of 175)
Sidechain	89.2 % (955 of 1071)	88.8 % (569 of 641)	90.4 % (375 of 415)	73.3 % (11 of 15)
Aromatic	78.6 % (110 of 140)	85.7 % (60 of 70)	70.6 % (48 of 68)	100.0 % (2 of 2)
Methyl	96.9 % (190 of 196)	95.9 % (94 of 98)	98.0 % (96 of 98)

1. M2AP

TFLELVEVPC NSVHVQGVMT PNQMVKVTGA GWDNGVLEFY VTRPTKTGGD TSRSHLASIM CYSKDIDGVP SDKAGKCFLK NFSGEDSSEI DEKEVSLPIK SHNDAFMFVC SSNDGSALQC DVFALDNTNS SDGWKVNTVD LGVSVSPDLA FGLTADGVKV KKLYASSGLT AINDDPSLGC KA

Show sample condition

Sample

Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 308 K, pH 5.9

#	Name	Isotope labeling	Type	Concentration
1	M2AP	[U-100% 13C; U-100% 15N]		0.5 mM

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LACS Plot; CA

Referencing offset: -0.27 ppm, Outliers: 3 Detail

Show chemical shift referencing parameters

Chemical shift reference

Atom type	Mol. common name	Atom group	Value	Ref. method	Ref. type	Shift ratio
13C	water	protons	4.69 ppm	internal	indirect	0.2514495
1H	water	protons	4.69 ppm	internal	direct	1.0
15N	water	protons	4.69 ppm	internal	indirect	0.1013291

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LACS Plot; CB

Referencing offset: -0.27 ppm, Outliers: 3 Detail

Show chemical shift referencing parameters

Chemical shift reference

Atom type	Mol. common name	Atom group	Value	Ref. method	Ref. type	Shift ratio
13C	water	protons	4.69 ppm	internal	indirect	0.2514495
1H	water	protons	4.69 ppm	internal	direct	1.0
15N	water	protons	4.69 ppm	internal	indirect	0.1013291

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LACS Plot; HA

Referencing offset: -0.04 ppm, Outliers: 3 Detail

Show chemical shift referencing parameters

Chemical shift reference

Atom type	Mol. common name	Atom group	Value	Ref. method	Ref. type	Shift ratio
13C	water	protons	4.69 ppm	internal	indirect	0.2514495
1H	water	protons	4.69 ppm	internal	direct	1.0
15N	water	protons	4.69 ppm	internal	indirect	0.1013291

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LACS Plot; CO

Referencing offset: 0.62 ppm, Outliers: 1 Detail

Show chemical shift referencing parameters

Chemical shift reference

Atom type	Mol. common name	Atom group	Value	Ref. method	Ref. type	Shift ratio
13C	water	protons	4.69 ppm	internal	indirect	0.2514495
1H	water	protons	4.69 ppm	internal	direct	1.0
15N	water	protons	4.69 ppm	internal	indirect	0.1013291

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Protein Blocks Logo

Calculated from 1 models in PDB: 2MPO, Strand ID: A Detail

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Release date

2009-03-02

Citation

Complete resonance assignments for the MIC2 associated protein from Toxoplasma gondii
Liu, B., Sawmynaden, K., Marchant, J., Simpson, P., Matthews, S.
Biomol. NMR Assign. (2009), 3, 81-83, PubMed 19636952 , DOI 10.1007/s12104-009-9146-8 , Abstract

Related entities 1. M2AP, : 1 : 2 entities Detail

Experiments performed 9 experiments Detail