3agx

Crystal structure of human Hsp40 Hdj1 peptide-binding domain

Method: X-RAY DIFFRACTION Dmax: 91.2 Å Quality: GOOD

1. Protein Identity and Related Structures Protein Identity & Related Structures

DnaJ homolog subfamily B member 1

Homo sapiens

UniProt P25685

State in the Current Structure

Assembly Oligomeric State Construct Mutations and Modifications Ligands, Ions and Associated Components Method and Experimental Conditions Structure Quality
1 Protein homooligomer Homooligomer Protein × 2 PDB declaration: dimeric(2) Consistent with protein copy count Chain A; UniProt 161–340 Chain B; UniProt 161–340 Fragment:UNP residues 161-340 No other associated polymer X-RAY DIFFRACTION X-ray crystallization conditions:VAPOR DIFFUSION, HANGING DROP;pH 6;293 K;13% PEG 3350, 0.1M Na citrate, pH 6.0, VAPOR DIFFUSION, HANGING DROP, temperature 293K Resolution 1.85 Å R-free 0.247

Other States of the Same Protein in the Database

Each row is a biological assembly of the same UniProt protein in another PDB entry. The “Difference from current entry” column identifies evidence-level differences; no tag means the currently parsed fields agree.

14 other PDB entries and 21 assemblies. Open the comparison page and filter oligomeric states

View Construct and Data Evidence
UniProt name DNJB1_HUMAN
Isoform
PDB entities 1
Chains and sequence ranges Author chain A; PDBConstruct 2–181; UniProt 161–340 Author chain B; PDBConstruct 2–181; UniProt 161–340

The page prioritizes protein identity, the current assembly, associated components, oligomeric state and cross-PDB links. Chain mapping and sequence ranges are retained as data evidence. Internal IDs, import timestamps and assembly operation expressions are maintenance fields and are not shown here.

SAXS scattering curve SAXS Profile

SAXS profile for 3agx

P(r) Distance Distribution P(r) Distribution

P(r) distribution for 3agx
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2. Structure Basics 2. Structure Basics

Entry ID entry_id3agx
Deposition date deposition_date2010-04-12
Structure title titleCrystal structure of human Hsp40 Hdj1 peptide-binding domain
Keywords keywordschaperone; CHAPERONE
Experimental Method methodX-RAY DIFFRACTION

3. SAXS Parameters (CRYSOL theoretical calculation) 3. SAXS Parameters (CRYSOL)

Radius of gyration Rg (Guinier) rg_guinier29.42
Radius of gyration Rg (electron density) rg_electron28.66
Forward intensity I(0) i020553900.00
Molecular weight molecular_weight36685.0 kDa
Excluded volume excluded_volume46750 ų
Envelope volume envelope_volume65719 ų
Hydration-shell volume shell_volume19787 ų
Envelope diameter envelope_diameter97.2
Shell Rg shell_rg34.76
Envelope Rg envelope_rg27.94
Shape Rg shape_rg28.64
Total Rg total_rg29.44
Total atoms total_atoms2579
Residues n_residues324
Spherical-harmonic order n_harmonics20
q range q_range— – 0.5000 −1
Data points n_points101
Shell type shell_typedirectional
Solvent electron density solvent_density0.3340 e/ų
Shell contrast contrast_shell0.0300 e/ų
CRYSOL version crysol_version4.1.3

4. P(r) Distance Distribution (GNOM inversion) 4. P(r) Analysis (GNOM)

Maximum dimension Dmax dmax91.2
Rg (real space) rg_real29.42
Rg uncertainty (real space) rg_real_error0.75
I(0) (real space) i0_real2.0550e+07
I(0) uncertainty (real space) i0_real_error3.4210e+05
Rg (reciprocal space) rg_reciprocal29.43
I(0) (reciprocal space) i0_reciprocal20550000.0000
Solution quality estimate total_estimate0.8690
Solution quality rating solution_quality GOOD a GOOD solution
P(r) peaks n_peaks3
Primary peak position r_peak_primary45.6
Skewness Skewness skewness0.104
Kurtosis Kurtosis kurtosis-0.758
Angular range angular_range— – 0.2700 −1
Current regularization parameter α current_alpha0.0000
Highest regularization parameter α highest_alpha1961000.0000
Real-space data points n_real_points55
GNOM version gnom_version4.1.3
Quality Criteria quality_criteria AN1: 0.000; Oscil: 0.830; Stabil: 1.000; Sysdev: 1.000; Positv: 1.000; Valcen: 0.884; Smooth: 0.920

5. Crystallography and Experiment 5. Crystallography & Experiment

6. Entities and Polymers Entities & Polymers (2)

7. Fold Classification (SCOP + CATH) 8 domains

SCOP 2.08 (4 domains)

Domain ID domain_idd3agxa1
Class classb — All beta proteins
Fold Fold foldb.4 — HSP40/DnaJ peptide-binding domain
Superfamily Superfamily superfamilyb.4.1 — HSP40/DnaJ peptide-binding domain
Family Family familyb.4.1.0 — automated matches
Domain ID domain_idd3agxa2
Class classb — All beta proteins
Fold Fold foldb.4 — HSP40/DnaJ peptide-binding domain
Superfamily Superfamily superfamilyb.4.1 — HSP40/DnaJ peptide-binding domain
Family Family familyb.4.1.0 — automated matches
Domain ID domain_idd3agxb1
Class classb — All beta proteins
Fold Fold foldb.4 — HSP40/DnaJ peptide-binding domain
Superfamily Superfamily superfamilyb.4.1 — HSP40/DnaJ peptide-binding domain
Family Family familyb.4.1.0 — automated matches
Domain ID domain_idd3agxb2
Class classb — All beta proteins
Fold Fold foldb.4 — HSP40/DnaJ peptide-binding domain
Superfamily Superfamily superfamilyb.4.1 — HSP40/DnaJ peptide-binding domain
Family Family familyb.4.1.0 — automated matches

CATH v4.4 (4 domains)

Domain ID domain_id3agxA01
Class class2 — Mainly Beta
Architecture architecture60 — Sandwich
Topology topology260 — HSP40/DNAj peptide-binding domain
Homologous superfamily homologous superfamily20 — Urease metallochaperone UreE, N-terminal domain
Domain ID domain_id3agxA02
Class class2 — Mainly Beta
Architecture architecture60 — Sandwich
Topology topology260 — HSP40/DNAj peptide-binding domain
Homologous superfamily homologous superfamily20 — Urease metallochaperone UreE, N-terminal domain
Domain ID domain_id3agxB01
Class class2 — Mainly Beta
Architecture architecture60 — Sandwich
Topology topology260 — HSP40/DNAj peptide-binding domain
Homologous superfamily homologous superfamily20 — Urease metallochaperone UreE, N-terminal domain
Domain ID domain_id3agxB02
Class class2 — Mainly Beta
Architecture architecture60 — Sandwich
Topology topology260 — HSP40/DNAj peptide-binding domain
Homologous superfamily homologous superfamily20 — Urease metallochaperone UreE, N-terminal domain

8. Citations (1)

9. Files and Curves (10)