BMRB Entry 16309

Chem Shift validation: AVS_anomalous, AVS_full, LACS
BMRB Entry DOI: doi:10.13018/BMR16309

NMR-STAR file interactive viewer.
NMR-STAR v3 text file.
XML gzip file.
RDF gzip file.
All files associated with the entry

Title:
15N, 13C cL-BABP T91C holo
Deposition date:
2009-05-21
Original release date:
2009-10-14
Authors:
Cogliati, Clelia; Tomaselli, Simona; Assfalg, Michael; Pedo, Massimo; Zetta, Lucia; Molinari, Henriette; Ragona, Laura
Citation:

Citation: Cogliati, Clelia; Tomaselli, Simona; Assfalg, Michael; Pedo, Massimo; Ferranti, Pasquale; Zetta, Lucia; Molinari, Henriette; Ragona, Laura. "Disulfide bridge regulates ligand-binding site selectivity in liver bile acid-binding proteins."  FEBS J. 276, 6011-6023 (2009).
PubMed: 19754879

Assembly members:

Assembly members:
holo_T91C, polymer, 125 residues, Formula weight is not available
JN3, non-polymer, 392.572 Da.

Natural source:

Natural source:   Common Name: chicken   Taxonomy ID: 9031   Superkingdom: Eukaryota   Kingdom: Metazoa   Genus/species: Gallus gallus

Experimental source:

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

Entity Sequences (FASTA):

Entity Sequences (FASTA):
holo_T91C: AFSGTWQVYAQENYEEFLKA LALPEDLIKMARDIKPIVEI QQKGDDFVVTSKTPRQTVTN SFTLGKEADITTMDGKKLKC TVHLANGKLVCKSEKFSHEQ EVKGNEMVETITFGGVTLIR RSKRV

Data sets:
Data typeCount
13C chemical shifts237
15N chemical shifts116
1H chemical shifts115

Additional metadata:

  • Assembly
  • Samples and Experiments
  • Software
  • Spectrometers
  • Hide all

Assembly:

Entity Assembly IDEntity NameEntity ID
1chain A1

Entities:

Entity 1, chain A 125 residues - Formula weight is not available

1   ALAPHESERGLYTHRTRPGLNVALTYRALA
2   GLNGLUASNTYRGLUGLUPHELEULYSALA
3   LEUALALEUPROGLUASPLEUILELYSMET
4   ALAARGASPILELYSPROILEVALGLUILE
5   GLNGLNLYSGLYASPASPPHEVALVALTHR
6   SERLYSTHRPROARGGLNTHRVALTHRASN
7   SERPHETHRLEUGLYLYSGLUALAASPILE
8   THRTHRMETASPGLYLYSLYSLEULYSCYS
9   THRVALHISLEUALAASNGLYLYSLEUVAL
10   CYSLYSSERGLULYSPHESERHISGLUGLN
11   GLUVALLYSGLYASNGLUMETVALGLUTHR
12   ILETHRPHEGLYGLYVALTHRLEUILEARG
13   ARGSERLYSARGVAL

Samples:

sample_1: holo T91C, [U-100% 13C; U-100% 15N], 0.5 mM; sodium phosphate 30 mM; H2O 90%; D2O 10%

sample_conditions_1: pH: 7.2; pressure: 1 atm; temperature: 298 K

Experiments:

NameSampleSample stateSample conditions
2D 1H-15N HSQCsample_1isotropicsample_conditions_1
3D HNCACBsample_1isotropicsample_conditions_1
3D CBCA(CO)NHsample_1isotropicsample_conditions_1
3D 1H-15N NOESYsample_1isotropicsample_conditions_1
3D 1H-15N TOCSYsample_1isotropicsample_conditions_1

Software:

NMRView, Johnson, One Moon Scientific - chemical shift assignment

NMR spectrometers:

  • Bruker Avance 600 MHz
  • Bruker DMX 500 MHz

Related Database Links:

BMRB 15084 15854 16310 16458 17767
PDB
GB AAK58094 ADE59142 ADE59143 ADE59144 ADE59145
PRF 2106165A
REF NP_989965 XP_003212677
SP P80226
AlphaFold P80226

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