BMRB Entry 19984

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PDB ID:
Entry in NMR Restraints Grid
Validation report in NRG-CING
Chem Shift validation: AVS_full, LACS
BMRB Entry DOI: doi:10.13018/BMR19984
MolProbity Validation Chart

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Title:
1H, 13C, 15N Resonance Assignment of the Chitin-Active Lytic Polysaccharide Monooxygenase BlLPMO10A from Bacillus licheniformis
Deposition date:
2014-05-21
Original release date:
2016-04-25
Authors:
Courtade, Gaston; Balzer, Simone; Forsberg, Zarah; Vaaje-Kolstad, Gustav; Eijsink, Vincent; Aachmann, Finn
Citation:

Citation: Courtade, Gaston; Balzer, Simone; Forsberg, Zarah; Vaaje-Kolstad, Gustav; Eijsink, Vincent; Aachmann, Finn. "1H, 13C, 15N resonance assignment of the chitin-active lytic polysaccharide monooxygenase BlLPMO10A from Bacillus licheniformis"  Biomol. NMR Assignments ., .-. (2016).

Assembly members:

Assembly members:
BlLPMO10A, polymer, 172 residues, Formula weight is not available

Natural source:

Natural source:   Common Name: Clostridium licheniforme   Taxonomy ID: 1402   Superkingdom: Bacteria   Kingdom: not available   Genus/species: Bacillus licheniformis

Experimental source:

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

Entity Sequences (FASTA):

Entity Sequences (FASTA):
BlLPMO10A: HGFIEKPGSRAALCSEAFGF LNLNCGSVMYEPQSLEAKKG FPHSGPADGQIASAGGLFGG ILDQQSENRWFKHIMTGGEH TFTWTYTAPHNTSQWHYYIT KKGWDPDKPLKRADFELIGA VPHDGSPASRNLSHHIYIPE DRLGYHVILAVWDVADTENA FYQVIDVDLVNK

Data sets:
Data typeCount
13C chemical shifts675
15N chemical shifts177
1H chemical shifts1069

Additional metadata:

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

Entity Assembly IDEntity NameEntity ID
1BlLPMO10A1

Entities:

Entity 1, BlLPMO10A 172 residues - Formula weight is not available

1   HISGLYPHEILEGLULYSPROGLYSERARG
2   ALAALALEUCYSSERGLUALAPHEGLYPHE
3   LEUASNLEUASNCYSGLYSERVALMETTYR
4   GLUPROGLNSERLEUGLUALALYSLYSGLY
5   PHEPROHISSERGLYPROALAASPGLYGLN
6   ILEALASERALAGLYGLYLEUPHEGLYGLY
7   ILELEUASPGLNGLNSERGLUASNARGTRP
8   PHELYSHISILEMETTHRGLYGLYGLUHIS
9   THRPHETHRTRPTHRTYRTHRALAPROHIS
10   ASNTHRSERGLNTRPHISTYRTYRILETHR
11   LYSLYSGLYTRPASPPROASPLYSPROLEU
12   LYSARGALAASPPHEGLULEUILEGLYALA
13   VALPROHISASPGLYSERPROALASERARG
14   ASNLEUSERHISHISILETYRILEPROGLU
15   ASPARGLEUGLYTYRHISVALILELEUALA
16   VALTRPASPVALALAASPTHRGLUASNALA
17   PHETYRGLNVALILEASPVALASPLEUVAL
18   ASNLYS

Samples:

label_H2O: BlLPMO10A, [U-98% 13C; U-98% 15N], 1 – 1.5 mM; sodium phosphate 25 ± 0.1 mM; sodium chloride 10 ± 0.1 mM; D2O 10%; H2O 90%

label_D2O: BlLPMO10A, [U-98% 13C; U-98% 15N], 1 – 1.5 mM; sodium phosphate 25 ± 0.1 mM; sodium chloride 10 ± 0.1 mM; D2O 100%

non_H2O: BlLPMO10A1 – 1.5 mM; sodium phosphate 25 ± 0.1 mM; sodium chloride 10 ± 0.1 mM; D2O 10%; H2O 90%

non_D2O: BlLPMO10A1 – 1.5 mM; sodium phosphate 25 ± 0.1 mM; sodium chloride 10 ± 0.1 mM; D2O 100%

sample_conditions_1: ionic strength: 0.085 M; pH: 5.0; pressure: 1 atm; temperature: 298 K

Experiments:

NameSampleSample stateSample conditions
2D 1H-15N HSQClabel_H2Oisotropicsample_conditions_1
2D 1H-13C HSQClabel_H2Oisotropicsample_conditions_1
3D HNCOlabel_H2Oisotropicsample_conditions_1
3D HCACOlabel_H2Oisotropicsample_conditions_1
3D HNCAlabel_H2Oisotropicsample_conditions_1
3D HN(CO)CAlabel_H2Oisotropicsample_conditions_1
3D CBCA(CO)NHlabel_H2Oisotropicsample_conditions_1
3D CBCANHlabel_H2Oisotropicsample_conditions_1
3D HBHA(CO)NHlabel_H2Oisotropicsample_conditions_1
3D HBHANHlabel_H2Oisotropicsample_conditions_1
3D HCCH-COSYnon_D2Oisotropicsample_conditions_1
3D HCCH-TOCSYlabel_D2Oisotropicsample_conditions_1
2D 1H-1H TOCSYnon_H2Oisotropicsample_conditions_1
2D 1H-1H COSYnon_H2Oisotropicsample_conditions_1
2D 1H-1H NOESYnon_H2Oisotropicsample_conditions_1
2D 1H-1H TOCSYnon_D2Oisotropicsample_conditions_1
2D 1H-1H COSYnon_D2Oisotropicsample_conditions_1
2D 1H-1H NOESYnon_D2Oisotropicsample_conditions_1

Software:

TOPSPIN v2.1, Bruker Biospin - collection

CARA v1.5.1/1.8.4, Keller and Wuthrich - chemical shift assignment, data analysis

NMR spectrometers:

  • Bruker Avance 600 MHz

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