BMRB Entry 27447

Chem Shift validation: AVS_full, LACS
BMRB Entry DOI: doi:10.13018/BMR27447

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Title:
Backbone and side-chain methyl relaxation rates, methyl order parameters, and stereospecific resonance assignments for Zn(II) AdcR
Deposition date:
2018-04-12
Original release date:
2018-10-19
Authors:
Capdevila, Daiana; Edmonds, Katherine; Wu, Hongwei; Giedroc, David
Citation:

Citation: Capdevila, Daiana; Huerta, Fidel; Edmonds, Katherine; Le, My; Wu, Hongwei; Giedroc, David. "Tuning site-specific dynamics to drive allosteric activation in a pneumococcal zinc uptake regulator"  eLife 7, e37268-e37268 (2018).
PubMed: 30328810

Assembly members:

Assembly members:
AdcR_chain, polymer, 146 residues, Formula weight is not available
entity_ZN, non-polymer, 65.409 Da.

Natural source:

Natural source:   Common Name: Streptococcus pneumoniae   Taxonomy ID: 1313   Superkingdom: Bacteria   Kingdom: not available   Genus/species: Streptococcus pneumoniae

Experimental source:

Experimental source:   Production method: recombinant technology   Host organism: Escherichia coli   Vector: pET3a

Entity Sequences (FASTA):

Entity Sequences (FASTA):
AdcR_chain: MRQLAKDINAFLNEVILQAE NQHEILIGHCTSEVALTNTQ EHILMLLSEESLTNSELARR LNVSQAAVTKAIKSLVKEGM LETSKDSKDARVIFYQLTDL ARPIAEEHHHHHEHTLLTYE QVATQFTPNEQKVIQRFLTA LVGEIK

Data sets:
Data typeCount
13C chemical shifts529
15N chemical shifts142
1H chemical shifts388
T1 relaxation values142
T2 relaxation values446
heteronuclear NOE values142
order parameters72

Additional metadata:

  • Assembly
  • Samples and Experiments
  • Software
  • Spectrometers
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Assembly:

Entity Assembly IDEntity NameEntity ID
1AdcR_chain11
2AdcR_chain21
3Zn12
4Zn22
5Zn32
6Zn42

Entities:

Entity 1, AdcR_chain1 146 residues - Formula weight is not available

1   METARGGLNLEUALALYSASPILEASNALA
2   PHELEUASNGLUVALILELEUGLNALAGLU
3   ASNGLNHISGLUILELEUILEGLYHISCYS
4   THRSERGLUVALALALEUTHRASNTHRGLN
5   GLUHISILELEUMETLEULEUSERGLUGLU
6   SERLEUTHRASNSERGLULEUALAARGARG
7   LEUASNVALSERGLNALAALAVALTHRLYS
8   ALAILELYSSERLEUVALLYSGLUGLYMET
9   LEUGLUTHRSERLYSASPSERLYSASPALA
10   ARGVALILEPHETYRGLNLEUTHRASPLEU
11   ALAARGPROILEALAGLUGLUHISHISHIS
12   HISHISGLUHISTHRLEULEUTHRTYRGLU
13   GLNVALALATHRGLNPHETHRPROASNGLU
14   GLNLYSVALILEGLNARGPHELEUTHRALA
15   LEUVALGLYGLUILELYS

Entity 2, Zn1 - Zn - 65.409 Da.

1   ZN

Download HSQC peak lists in one of the following formats:
CSV: Backbone or all simulated peaks
SPARKY: Backbone or all simulated peaks