BMRB Entry 16731

Title:
Solution Structure of a putative disulphide-isomerase from Bacteroides thetaiotaomicron
Deposition date:
2010-02-17
Original release date:
2010-03-22
Authors:
Harris, R.; Bonanno, J.; Freeman, J.; Bain, K.; Sauder, J.; Burley, S.; Girvin, M.; Almo, S.
Citation:

Citation: Harris, R.; Bonanno, J.; Freeman, J.; Bain, K.; Sauder, J.; Burley, S.; Girvin, M.; Almo, S.. "Solution Structure of a putative disulphide-isomerase from Bacteroides thetaiotaomicron"  To be published ., .-..

Assembly members:

Assembly members:
putative_disulphide-isomerase, polymer, 130 residues, 14828.232 Da.

Natural source:

Natural source:   Common Name: Bacteroides thetaiotaomicron   Taxonomy ID: 818   Superkingdom: Bacteria   Kingdom: not available   Genus/species: Bacteroides thetaiotaomicron

Experimental source:

Experimental source:   Production method: recombinant technology   Host organism: Escherichia coli   Vector: modified pET26

Data sets:
Data typeCount
13C chemical shifts565
15N chemical shifts117
1H chemical shifts879

Additional metadata:

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

Assembly:

Entity Assembly IDEntity NameEntity ID
1putative disulphide-isomerase1

Entities:

Entity 1, putative disulphide-isomerase 130 residues - 14828.232 Da.

Sequence is amino acids 44-162 of Uniprot entry Q8A386. Residues A4-G124 used in structure calculations called A1-G121.

1   METSERLEUALAGLNALAASPGLYILEALA
2   PHEARGGLULEUSERPHEPROGLUALALEU
3   LYSARGALAGLUVALGLUASPLYSLEULEU
4   PHEVALASPCYSPHETHRTHRTRPCYSGLY
5   PROCYSLYSARGLEUSERLYSVALVALPHE
6   LYSASPSERLEUVALALAASPTYRPHEASN
7   ARGHISPHEVALASNLEULYSMETASPMET
8   GLULYSGLYGLUGLYVALGLULEUARGLYS
9   LYSTYRGLYVALHISALATYRPROTHRLEU
10   LEUPHEILEASNSERSERGLYGLUVALVAL
11   TYRARGLEUVALGLYALAGLUASPALAPRO
12   GLULEULEULYSLYSVALLYSLEUGLYVAL
13   GLUSERGLUGLYHISHISHISHISHISHIS

Samples:

sample_1: putative disulphide-isomerase, [U-13C; U-15N], 1 mM; sodium chloride 150 mM; sodium phosphate 20 mM; H2O 90%; D2O 10%

sample_2: putative disulphide-isomerase, [U-13C; U-15N], 1 mM; sodium chloride 150 mM; sodium phosphate 20 mM; D2O 100%

sample_conditions_1: ionic strength: 150 mM; pH: 7.5; pressure: 1.0 atm; temperature: 298 K

Experiments:

NameSampleSample stateSample conditions
15N HSQCsample_1isotropicsample_conditions_1
15N NOESY-HSQCsample_1isotropicsample_conditions_1
13C HSQCsample_2isotropicsample_conditions_1
aromatic 13C HSQCsample_2isotropicsample_conditions_1
13C NOESY-HSQCsample_2isotropicsample_conditions_1
aromatic 13C NOESY-HSQCsample_2isotropicsample_conditions_1

Software:

CNS, Brunger A. T. et.al. - refinement

CCPN_Analysis, Brunger A. T. et.al. - refinement

NMR spectrometers:

  • Varian Inova 600 MHz

Related Database Links:

PDB
GB AAO78175 EOR99586
REF NP_811981 WP_011108616 WP_016269119

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