BMRB Entry 52977

Name: NMR solution structure of recombinant GsAF2
Published: 2025-04-02

Click here to enlarge.

PDB ID: 9o5c
Entry in NMR Restraints Grid
Validation report in NRG-CING
Chem Shift validation: AVS_full
BMRB Entry DOI: doi:10.13018/BMR52977
MolProbity Validation Chart

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

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

Select model:

I am color blind

Download raw data. Direct link to this display. Help

Title:

NMR solution structure of recombinant GsAF2

Deposition date:

2025-03-23

Original release date:

2025-04-02

Authors:

Adhikary, Krishnakoli; Poget, Sebastien; Zhuang, Jianqin

Citation:

Citation: Adhikary, Krishnakoli; Poget, Sebastien; Zhuang, Jianqin. "Solution structure of recombinant GsAF2" .

Assembly members:

Assembly members:
entity_1, polymer, 32 residues, Formula weight is not available

Natural source:

Natural source: Common Name: Chilean rose tarantula Taxonomy ID: 432528 Superkingdom: Eukaryota Kingdom: Viridiplantae Genus/species: Grammostola rosea

Experimental source:

Experimental source: Production method: recombinant technology Host organism: Escherichia coli Vector: pMAL-c2x

Entity Sequences (FASTA):

Entity Sequences (FASTA):
entity_1: GYCQKWMWTCDEERKCCEGL VCRLWCKKKIEW

Data sets:

assigned_chemical_shifts
- assigned_chemical_shifts_1

Data type	Count
13C chemical shifts	87
15N chemical shifts	33
1H chemical shifts	198

Additional metadata:

Assembly
Samples and Experiments
Software
Spectrometers
Hide all

Assembly:

Entity Assembly ID	Entity Name	Entity ID
1	GsAF2	1

Entities:

Entity 1, GsAF2 32 residues - Formula weight is not available

1

GLY

TYR

CYS

GLN

LYS

TRP

MET

TRP

THR

CYS

2

ASP

GLU

ARG

LYS

CYS

GLU

GLY

LEU

3

VAL

CYS

ARG

LEU

TRP

CYS

LYS

ILE

4

GLU

TRP

Samples:

sample_1: GsAF2, [U-100% 15N], 200 uM

sample_2: GsAF2, [U-100% 13C; U-100% 15N], 60 uM

sample_conditions_1: pH: 6.95; temperature: 299 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
3D 1H-15N TOCSY	sample_1	isotropic	sample_conditions_1
2D 1H-13C HSQC	sample_2	isotropic	sample_conditions_1
3D 1H-13C NOESY	sample_2	isotropic	sample_conditions_1

Software:

CcpNMR v2.5.2 - chemical shift assignment, data analysis, peak picking, processing

TALOS+ - chemical shift calculation

ARIA2 v2.3 - processing, refinement, structure solution

NMR spectrometers:

Varian INOVA 600 MHz
Bruker Avance 800 MHz