BMRB Entry 50901

Name: SH3-PRR2 peptide complex
Published: 2022-07-09

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PDB ID: 7pll
Entry in NMR Restraints Grid
Validation report in NRG-CING
Chem Shift validation: AVS_full
BMRB Entry DOI: doi:10.13018/BMR50901
MolProbity Validation Chart

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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:

SH3-PRR2 peptide complex

Deposition date:

2021-04-19

Original release date:

2022-07-09

Authors:

Sokolik, Chana; Chill, Jordan

Citation:

Citation: Twafra, Shams; Sokolik, Chana; Sneh, Tal; Srikanth, Kolluru; Genna, Alessandro; Samson, Avraham; Dessau, Moshe; Chill, Jordan; Gil-Henn, Hava. "Molecular and cellular aspects of cortactin inhibition by a Pyk2-derived peptide" Mol. Cell ., .-..

Assembly members:

Assembly members:
entity_1, polymer, 57 residues, Formula weight is not available
entity_2, polymer, 19 residues, Formula weight is not available

Natural source:

Natural source: Common Name: Mouse Taxonomy ID: 10090 Superkingdom: Eukaryota Kingdom: Metazoa Genus/species: Mus musculus

Experimental source:

Experimental source: Production method: recombinant technology Host organism: Escherichia coli Vector: pET28a+

Entity Sequences (FASTA):

Entity Sequences (FASTA):
entity_1: GITAIALYDYQAAGDDEISF DPDDIITNIEMIDDGWWRGV CKGRYGLFPANYVELRQ
entity_2: TAFQEPPPKPSRPKYRPPP

Data sets:

assigned_chemical_shifts
- assigned_chemical_shifts_1

Data type	Count
13C chemical shifts	133
15N chemical shifts	60
1H chemical shifts	467

Additional metadata:

Assembly
Samples and Experiments
Software
Spectrometers
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Assembly:

Entity Assembly ID	Entity Name	Entity ID
1	SH3	1
2	PRR2	2

Entities:

Entity 1, SH3 57 residues - Formula weight is not available

1

GLY

ILE

THR

ALA

ILE

ALA

LEU

TYR

ASP

TYR

2

GLN

ALA

GLY

ASP

GLU

ILE

SER

PHE

3

ASP

PRO

ASP

ILE

THR

ASN

ILE

GLU

4

MET

ILE

ASP

GLY

TRP

ARG

GLY

VAL

5

CYS

LYS

GLY

ARG

TYR

GLY

LEU

PHE

PRO

ALA

6

ASN

TYR

VAL

GLU

LEU

ARG

GLN

Entity 2, PRR2 19 residues - Formula weight is not available

1

THR

ALA

PHE

GLN

GLU

PRO

LYS

PRO

2

SER

ARG

PRO

LYS

TYR

ARG

PRO

Name	Sample	Sample state	Sample conditions
2D 1H-15N HSQC	sample_4	isotropic	sample_conditions_1
2D 1H-1H TOCSY	sample_1	isotropic	sample_conditions_1
2D 1H-1H TOCSY	sample_2	isotropic	sample_conditions_1
2D 1H-1H COSY	sample_2	isotropic	sample_conditions_1
2D 1H-1H NOESY	sample_1	isotropic	sample_conditions_1
2D 1H-1H NOESY	sample_2	isotropic	sample_conditions_1
3D HNCACB	sample_4	isotropic	sample_conditions_1
3D 15N-separated NOESY	sample_6	isotropic	sample_conditions_1
2D 1H-1H NOESY	sample_6	isotropic	sample_conditions_1
3D 1H-13C NOESY aliphatic	sample_5	isotropic	sample_conditions_1
3D 1H-13C NOESY aromatic	sample_5	isotropic	sample_conditions_1
2D 1H-1H TOCSY	sample_6	isotropic	sample_conditions_1
2D 1H-1H NOESY	sample_6	isotropic	sample_conditions_1

UniProt	Q8BNA5 Q14289
AlphaFold	Q8BNA5 Q6PID4

BMRB Entry 50901

Additional metadata:

Assembly:

Entities:

Samples:

Experiments:

Software:

NMR spectrometers:

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