BMRB: 7296

Solution Conformation of the His 47 to Ala 47 Mutant of Pseudomonas stutzeri ZoBell Ferrocytochrome c-551

Authors

Liang, Q., Miller, G.T., Beeghley, C.A., Graf, C.B., Timkovich, R.

Assembly

H47A cyt c-551

Entity

1. H47A peptide chain (polymer, Thiol state: all other bound), 82 monomers, 8496.713 Da Detail

QDGEALFKSK PCAACHSVDT KMVGPALKEV AAKNAGVEGA ADTLALAIKN GSQGVWGPIP MPPNPVTEEE AKILAEWVLS LK

2. HEM (non-polymer), 616.487 Da

Total weight

9113.2 Da

Max. entity weight

8496.713 Da

Entity Connection

na 2, thioether 2 Detail

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ID	Type	Value order	Atom ID 1	Atom ID 2
1	thioether	sing	1:CYS12:SG	2:HEM1:CAB
2	thioether	sing	1:CYS15:SG	2:HEM1:CAC
3	na	sing	1:HIS16:NE2	2:HEM1:FE
4	na	sing	1:MET61:SD	2:HEM1:FE

Source organism

Pseudomonas stutzeri

Exptl. method

NMR

Refine. method

simulated annealing

Data set

assigned_chemical_shifts

Chem. Shift Complete

Sequence coverage: 100.0 %, Completeness: 97.6 %, Completeness (bb): 98.2 % Detail

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Polymer type: polypeptide(L)

	Total	1H
All	97.6 % (456 of 467)	97.6 % (456 of 467)
Backbone	98.2 % (161 of 164)	98.2 % (161 of 164)
Sidechain	97.4 % (295 of 303)	97.4 % (295 of 303)
Aromatic	100.0 % (19 of 19)	100.0 % (19 of 19)
Methyl	100.0 % (50 of 50)	100.0 % (50 of 50)

1. H47A peptide chain

QDGEALFKSK PCAACHSVDT KMVGPALKEV AAKNAGVEGA ADTLALAIKN GSQGVWGPIP MPPNPVTEEE AKILAEWVLS LK

Show sample condition

Sample

Temperature 298 (±1) K, pH 7.00 (±0.1)

#	Name	Isotope labeling	Type	Concentration
1	H47A c-551			1.5 mM
2	H2O			10 %
3	D2O			90 %
4	sodium phosphate buffer			50 mM
5	sodium dithionite			10 mM

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Protein Blocks Logo

Calculated from 1 models in PDB: 2I8F, Strand ID: A Detail

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Release date

2007-10-08

Citation

Solution conformation of the His-47 to Ala-47 mutant of Pseudomonas stutzeri ZoBell ferrocytochrome c-551
Liang, Q., Miller, G.T., Beeghley, C.A., Graf, C.B., Timkovich, R.
Biophys. J. (2007), 93, 1700-1706, PubMed 17496029 , DOI 10.1529/biophysj.106.102772 , Abstract

Related entities 1. H47A peptide chain, : 1 : 3 : 54 entities Detail

Experiments performed 3 experiments Detail