BMRB: 6692

1H, 13C, and 15N Chemical Shift Assignments for AppA 5-125

Authors

Grinstead, J.S., Hsu, S.D., Laan, W., Bonvin, A.M.J.J., Hellingwerf, K., Boelens, R., Kaptein, R.

Assembly

AppA

Entity

1. AppA (polymer, Thiol state: all free), 121 monomers, 13492.07 Da Detail

LEADVTMTGS DLVSCCYRSL AAPDLTLRDL LDIVETSQAH NARAQLTGAL FYSQGVFFQW LEGHPAAVAE VMSHIQRDRR HSNVEILAEE SIAKRRFAGW HMQLSCSEAD MRSLGLAESR Q

2. FAD (non-polymer), 785.550 Da

Total weight

14277.62 Da

Max. entity weight

13492.07 Da

Source organism

Cereibacter sphaeroides

Exptl. method

NMR

Refine. method

ARIA

Data set

assigned_chemical_shifts

Chem. Shift Complete

Sequence coverage: 99.2 %, Completeness: 82.5 %, Completeness (bb): 81.7 % Detail

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Polymer type: polypeptide(L)

	Total	1H	13C	15N
All	82.5 % (1119 of 1357)	92.0 % (642 of 698)	66.7 % (353 of 529)	95.4 % (124 of 130)
Backbone	81.7 % (590 of 722)	98.0 % (241 of 246)	65.3 % (233 of 357)	97.5 % (116 of 119)
Sidechain	84.5 % (634 of 750)	88.7 % (401 of 452)	78.4 % (225 of 287)	72.7 % (8 of 11)
Aromatic	56.0 % (56 of 100)	92.0 % (46 of 50)	18.8 % (9 of 48)	50.0 % (1 of 2)
Methyl	92.1 % (129 of 140)	91.4 % (64 of 70)	92.9 % (65 of 70)

1. AppA

LEADVTMTGS DLVSCCYRSL AAPDLTLRDL LDIVETSQAH NARAQLTGAL FYSQGVFFQW LEGHPAAVAE VMSHIQRDRR HSNVEILAEE SIAKRRFAGW HMQLSCSEAD MRSLGLAESR Q

Show sample condition

Sample #1

Temperature 310 (±1) K, pH 7.4 (±0.1)

#	Name	Isotope labeling	Type	Concentration
1	AppA	[U-13C; U-15N]	protein	1.7 mM
2	FAD		ligand	1.7 mM

Sample #2

Temperature 310 (±1) K, pH 7.4 (±0.1)

#	Name	Isotope labeling	Type	Concentration
3	AppA	[U-15N]	protein	1.7 mM
4	FAD		ligand	0.0 ~ 0.0 mM

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Protein Blocks Logo

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

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Release date

2007-02-04

Citation

The solution structure of the AppA BLUF domain: insight into the mechanism of light-induced signaling
Grinstead, J.S., Hsu, S.D., Laan, W., Bonvin, A.M.J.J., Hellingwerf, K.J., Boelens, R., Kaptein, R.
Chembiochem. (2006), 7, 187-193, PubMed 16323221 , DOI 10.1002/cbic.200500270 , Abstract

Related entities 1. AppA, : 1 : 25 entities Detail

Experiments performed 4 experiments Detail