BMRB Entry 4958

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PDB ID: 2nbi
Entry in NMR Restraints Grid
Validation report in NRG-CING
Chem Shift validation: AVS_anomalous, AVS_full, LACS
BMRB Entry DOI: doi:10.13018/BMR4958
MolProbity Validation Chart

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Nicholas Rego and David Koes
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Bioinformatics (2015) 31 (8): 1322-1324 doi:10.1093/bioinformatics/btu829

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Title:

1H, 13C and 15N Sequence-specific Resonance Assignment of the PSCD4 Domain of Diatom cell wall Protein Pleuralin-1

Deposition date:

2001-02-20

Original release date:

2002-04-03

Authors:

Wenzler, Michael; Brunner, Eike; Kroger, Nils; Lehmann, Gerhard; Sumper, Manfred; Kalbitzer, Hans; De Sanctis, Silvia; Malloni, Wilhelm

Citation:

Citation: Wenzler, Michael; Brunner, Eike; Kroger, Nils; Lehmann, Gerhard; Sumper, Manfred; Kalbitzer, Hans. "Letter to the Editor: 1H, 13C and 15N Sequence-specific Resonance Assignment of the PSCD4 Domain of Diatom cell wall Protein Pleuralin-1" J. Biomol. NMR 20, 191-192 (2001).

Assembly members:

Assembly members:
pleuralin-1, formerly HEP200, polymer, 112 residues, 11946 Da.

Natural source:

Natural source: Common Name: Cylindrotheca fusiformis Taxonomy ID: 2853 Superkingdom: Eukaryota Kingdom: not available Genus/species: Cylindrotheca fusiformis

Experimental source:

Experimental source: Production method: recombinant technology

Entity Sequences (FASTA):

Entity Sequences (FASTA):
pleuralin-1, formerly HEP200: SYYHHHHHHTMMPSPEPSSQ PSDCGEVIEECPIDACFLPK SDSARPPDCTAVGRPDCNVL PFPNNIGCPSCCPFECSPDN PMFTPSPDGSPPNCSPTMLP SPSPSAVTVPLT

Data sets:

assigned_chemical_shifts
- shift_set_1

Data type	Count
13C chemical shifts	391
15N chemical shifts	86
1H chemical shifts	597

Additional metadata:

Assembly
Samples and Experiments
Software
Spectrometers
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Assembly:

Entity Assembly ID	Entity Name	Entity ID
1	His6PSCD4	1

Entities:

Entity 1, His6PSCD4 112 residues - 11946 Da.

1

SER

TYR

HIS

THR

2

MET

PRO

SER

PRO

GLU

PRO

SER

GLN

3

PRO

SER

ASP

CYS

GLY

GLU

VAL

ILE

GLU

4

CYS

PRO

ILE

ASP

ALA

CYS

PHE

LEU

PRO

LYS

5

SER

ASP

SER

ALA

ARG

PRO

ASP

CYS

THR

6

ALA

VAL

GLY

ARG

PRO

ASP

CYS

ASN

VAL

LEU

7

PRO

PHE

PRO

ASN

ILE

GLY

CYS

PRO

SER

8

CYS

PRO

PHE

GLU

CYS

SER

PRO

ASP

ASN

9

PRO

MET

PHE

THR

PRO

SER

PRO

ASP

GLY

SER

10

PRO

ASN

CYS

SER

PRO

THR

MET

LEU

PRO

11

SER

PRO

SER

PRO

SER

ALA

VAL

THR

VAL

PRO

12

LEU

THR

Samples:

unlabeled: pleuralin-1, formerly HEP200 0.8 mM

15N_labeled: pleuralin-1, formerly HEP200, [U-97% 15N], 0.8 mM

13C_15N_labeled: pleuralin-1, formerly HEP200, [U-97% 13C; U-98% 15N], 0.8 mM

Ex-cond_1: pH: 6.5; temperature: 298 K

Experiments:

Name	Sample	Sample state	Sample conditions
HNCA	not available	not available	Ex-cond_1
CBCA(CO)NH	not available	not available	Ex-cond_1
1H-15N-HSQC	not available	not available	Ex-cond_1
1H-15N-NOESY HSQC	not available	not available	Ex-cond_1
1H-15N-TOCSY HSQC	not available	not available	Ex-cond_1
HNCO	not available	not available	Ex-cond_1
HACACO	not available	not available	Ex-cond_1
HCCH-TOCSY	not available	not available	Ex-cond_1

Software:

No software information available

NMR spectrometers:

Bruker DRX 600 MHz
Bruker DRX 800 MHz