7cce

crystal structure of Arabidopsis AIPP3 BAH domain in complex with an H3K27me3 peptide

Method: X-RAY DIFFRACTION Dmax: 57.3 Å Quality: GOOD

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

Bromo-adjacent homology (BAH) domain-containing protein

Arabidopsis thaliana

UniProt Q8RXT5

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 heterocomplex Heteromer Protein × 2 PDB declaration: dimeric(2) Consistent with protein copy count Chain A; UniProt 112–279 Not recorded Histone H3.2 × 1 (P59226) TRS 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL × 1 X-RAY DIFFRACTION X-ray crystallization conditions:VAPOR DIFFUSION, SITTING DROP;pH 7;277 K;0.1 M HEPES, pH 7.0, and 2.4 M ammonium sulfate Resolution 2.40 Å R-free 0.266

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.

No other PDB entry for the same UniProt protein was found.

View Construct and Data Evidence
UniProt name Q8RXT5_ARATH
Isoform
PDB entities 1
Chains and sequence ranges Author chain A; PDBConstruct 2–169; UniProt 112–279

Histone H3.2

OrganismNot specified

UniProt P59226

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 heterocomplex Heteromer Protein × 2 PDB declaration: dimeric(2) Consistent with protein copy count Chain P; UniProt 21–38 Non-standard monomer:Yes (specific site not provided by mmCIF) Bromo-adjacent homology (BAH) domain-containing protein × 1 (Q8RXT5) TRS 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL × 1 X-RAY DIFFRACTION X-ray crystallization conditions:VAPOR DIFFUSION, SITTING DROP;pH 7;277 K;0.1 M HEPES, pH 7.0, and 2.4 M ammonium sulfate Resolution 2.40 Å R-free 0.266

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.

36 other PDB entries and 47 assemblies. Open the comparison page and filter oligomeric states

View Construct and Data Evidence
UniProt name H32_ARATH
Isoform
PDB entities 2
Chains and sequence ranges Author chain P; PDBConstruct 1–18; UniProt 21–38

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 7cce

P(r) Distance Distribution P(r) Distribution

P(r) distribution for 7cce
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2. Structure Basics 2. Structure Basics

Entry ID entry_id7cce
Deposition date deposition_date2020-06-17
Structure title titlecrystal structure of Arabidopsis AIPP3 BAH domain in complex with an H3K27me3 peptide
Keywords keywordsBAH domain, AIPP3, H3K27me3, histone modification, epigenetcis, GENE REGULATION; GENE REGULATION
Experimental Method methodX-RAY DIFFRACTION

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

Radius of gyration Rg (Guinier) rg_guinier17.77
Radius of gyration Rg (electron density) rg_electron16.26
Forward intensity I(0) i07313800.00
Molecular weight molecular_weight19922.0 kDa
Excluded volume excluded_volume25077 ų
Envelope volume envelope_volume29319 ų
Hydration-shell volume shell_volume15188 ų
Envelope diameter envelope_diameter57.6
Shell Rg shell_rg22.19
Envelope Rg envelope_rg16.74
Shape Rg shape_rg16.22
Total Rg total_rg17.47
Total atoms total_atoms1405
Residues n_residues170
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 dmax57.3
Rg (real space) rg_real17.65
Rg uncertainty (real space) rg_real_error0.36
I(0) (real space) i0_real7.3140e+06
I(0) uncertainty (real space) i0_real_error9.2020e+04
Rg (reciprocal space) rg_reciprocal17.67
I(0) (reciprocal space) i0_reciprocal7314000.0000
Solution quality estimate total_estimate0.8134
Solution quality rating solution_quality GOOD a GOOD solution
P(r) peaks n_peaks2
Primary peak position r_peak_primary51.2
Skewness Skewness skewness0.144
Kurtosis Kurtosis kurtosis-0.408
Angular range angular_range— – 0.4500 −1
Current regularization parameter α current_alpha0.0000
Highest regularization parameter α highest_alpha1456000.0000
Real-space data points n_real_points76
GNOM version gnom_version4.1.3
Quality Criteria quality_criteria AN1: 0.000; Oscil: 0.857; Stabil: 1.000; Sysdev: 1.000; Positv: 1.000; Valcen: 1.000; Smooth: 0.000

5. Crystallography and Experiment 5. Crystallography & Experiment

6. Entities and Polymers Entities & Polymers (4)

7. Fold Classification (SCOP + CATH) 1 domains

CATH v4.4 (1 domains)

Domain ID domain_id7cceA01
Class class2 — Mainly Beta
Architecture architecture30 — Roll
Topology topology30 — SH3 type barrels.
Homologous superfamily homologous superfamily490 — Bromo adjacent homology (BAH) domain

8. Citations (1)

9. Files and Curves (10)