BMRB Entry 17698

Name: HP67 H41F
Published: 2015-04-23

Chem Shift validation: AVS_full
BMRB Entry DOI: doi:10.13018/BMR17698

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Nicholas Rego and David Koes
3Dmol.js: molecular visualization with WebGL
Bioinformatics (2015) 31 (8): 1322-1324 doi:10.1093/bioinformatics/btu829

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Title:

HP67 H41F

Deposition date:

2011-06-12

Original release date:

2015-04-23

Authors:

Brown, Jeffrey; Farelli, Jeremiah; McKnight, Christopher

Citation:

Citation: Brown, Jeffrey; Farelli, Jeremiah; McKnight, Christopher. "On unsatisfied hydrogen bonds in the N-terminal subdomain of villin headpiece" J. Mol. Biol. 413, 543-547 (2011).
PubMed: 21903098

Assembly members:

Assembly members:
HP67_H41F, polymer, 67 residues, Formula weight is not available

Natural source:

Natural source: Common Name: E. coli Taxonomy ID: 562 Superkingdom: Bacteria Kingdom: not available Genus/species: Escherichia coli

Experimental source:

Experimental source: Production method: recombinant technology Host organism: Escherichia coli Vector: HP67_H41F

Entity Sequences (FASTA):

Entity Sequences (FASTA):
HP67_H41F: PTKLETFPLDVLVNTAAEDL PRGVDPSRKENFLSDEDFKA VFGMTRSAFANLPLWKQQNL KKEKGLF

Data sets:

assigned_chemical_shifts
- assigned_chem_shift_list_1
heteronucl_NOEs
spectral_peak_list
- peak_list_1

Data type	Count
15N chemical shifts	67
1H chemical shifts	73
heteronuclear NOE values	219

Additional metadata:

Assembly
Samples and Experiments
Software
Spectrometers
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Assembly:

Entity Assembly ID	Entity Name	Entity ID
1	HP67 H41F	1

Entities:

Entity 1, HP67 H41F 67 residues - Formula weight is not available

1

PRO

THR

LYS

LEU

GLU

THR

PHE

PRO

LEU

ASP

2

VAL

LEU

VAL

ASN

THR

ALA

GLU

ASP

LEU

3

PRO

ARG

GLY

VAL

ASP

PRO

SER

ARG

LYS

GLU

4

ASN

PHE

LEU

SER

ASP

GLU

ASP

PHE

LYS

ALA

5

VAL

PHE

GLY

MET

THR

ARG

SER

ALA

PHE

ALA

6

ASN

LEU

PRO

LEU

TRP

LYS

GLN

ASN

LEU

7

LYS

GLU

LYS

GLY

LEU

PHE

Samples:

sample_1: HP67 H41F, [U-99% 15N], 1.4 mM; H2O 95%; D2O 5%

sample_conditions_1: ionic strength: 0.01 M; pH: 7.0; pressure: 1 atm; temperature: 277 K

Experiments:

Name	Sample	Sample state	Sample conditions
2D 1H-15N HSQC	sample_1	isotropic	sample_conditions_1
3D 1H-15N NOESY	sample_1	isotropic	sample_conditions_1

Software:

NMRView, Johnson, One Moon Scientific - chemical shift assignment, data analysis, peak picking

NMRPipe, Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax - processing

xwinnmr, Bruker Biospin - collection

NMR spectrometers:

Bruker DMX 500 MHz