6wvw

Crystal structure of the R59P-SNAP25 containing SNARE complex

Method: X-RAY DIFFRACTION Dmax: 113.2 Å Quality: GOOD

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

Vesicle-associated membrane protein 2

Rattus norvegicus

UniProt P63045

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 × 4 PDB declaration: tetrameric(4) Consistent with protein copy count Chain A; UniProt 28–89 Not recorded Syntaxin-1A × 1 (P32851) Synaptosomal-associated protein 25 × 1 (P60881) Synaptosomal-associated protein 25 × 1 (P60881) CA CALCIUM ION × 2 MPD (4S)-2-METHYL-2,4-PENTANEDIOL × 1 X-RAY DIFFRACTION X-ray crystallization conditions:VAPOR DIFFUSION, HANGING DROP;pH 7.4;293 K;100 mM MES (pH 6.0), 100 mM CaCl2, 20-25% (v/v) Resolution 2.11 Å R-free 0.244
2 Protein heterocomplex Heteromer Protein × 4 PDB declaration: tetrameric(4) Consistent with protein copy count Chain E; UniProt 28–89 Not recorded Syntaxin-1A × 1 (P32851) Synaptosomal-associated protein 25 × 1 (P60881) Synaptosomal-associated protein 25 × 1 (P60881) CA CALCIUM ION × 2 MPD (4S)-2-METHYL-2,4-PENTANEDIOL × 1 X-RAY DIFFRACTION X-ray crystallization conditions:VAPOR DIFFUSION, HANGING DROP;pH 7.4;293 K;100 mM MES (pH 6.0), 100 mM CaCl2, 20-25% (v/v) Resolution 2.11 Å R-free 0.244

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.

22 other PDB entries and 27 assemblies. Open the comparison page and filter oligomeric states

View Construct and Data Evidence
UniProt name VAMP2_RAT
Isoform
PDB entities 1
Chains and sequence ranges Author chain A; PDBConstruct 2–63; UniProt 28–89 Author chain E; PDBConstruct 2–63; UniProt 28–89

Syntaxin-1A

Rattus norvegicus

UniProt P32851

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 × 4 PDB declaration: tetrameric(4) Consistent with protein copy count Chain B; UniProt 191–256 Not recorded Vesicle-associated membrane protein 2 × 1 (P63045) Synaptosomal-associated protein 25 × 1 (P60881) Synaptosomal-associated protein 25 × 1 (P60881) CA CALCIUM ION × 2 MPD (4S)-2-METHYL-2,4-PENTANEDIOL × 1 X-RAY DIFFRACTION X-ray crystallization conditions:VAPOR DIFFUSION, HANGING DROP;pH 7.4;293 K;100 mM MES (pH 6.0), 100 mM CaCl2, 20-25% (v/v) Resolution 2.11 Å R-free 0.244
2 Protein heterocomplex Heteromer Protein × 4 PDB declaration: tetrameric(4) Consistent with protein copy count Chain F; UniProt 191–256 Not recorded Vesicle-associated membrane protein 2 × 1 (P63045) Synaptosomal-associated protein 25 × 1 (P60881) Synaptosomal-associated protein 25 × 1 (P60881) CA CALCIUM ION × 2 MPD (4S)-2-METHYL-2,4-PENTANEDIOL × 1 X-RAY DIFFRACTION X-ray crystallization conditions:VAPOR DIFFUSION, HANGING DROP;pH 7.4;293 K;100 mM MES (pH 6.0), 100 mM CaCl2, 20-25% (v/v) Resolution 2.11 Å R-free 0.244

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.

53 other PDB entries and 71 assemblies. Open the comparison page and filter oligomeric states

View Construct and Data Evidence
UniProt name STX1A_RAT
Isoform
PDB entities 2
Chains and sequence ranges Author chain B; PDBConstruct 1–66; UniProt 191–256 Author chain F; PDBConstruct 1–66; UniProt 191–256

Synaptosomal-associated protein 25

Rattus norvegicus

UniProt P60881

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 × 4 PDB declaration: tetrameric(4) Consistent with protein copy count Chain C; UniProt 10–83 Chain D; UniProt 141–204 Mutation:R59P Vesicle-associated membrane protein 2 × 1 (P63045) Syntaxin-1A × 1 (P32851) CA CALCIUM ION × 2 MPD (4S)-2-METHYL-2,4-PENTANEDIOL × 1 X-RAY DIFFRACTION X-ray crystallization conditions:VAPOR DIFFUSION, HANGING DROP;pH 7.4;293 K;100 mM MES (pH 6.0), 100 mM CaCl2, 20-25% (v/v) Resolution 2.11 Å R-free 0.244
2 Protein heterocomplex Heteromer Protein × 4 PDB declaration: tetrameric(4) Consistent with protein copy count Chain G; UniProt 10–83 Chain H; UniProt 141–204 Mutation:R59P Vesicle-associated membrane protein 2 × 1 (P63045) Syntaxin-1A × 1 (P32851) CA CALCIUM ION × 2 MPD (4S)-2-METHYL-2,4-PENTANEDIOL × 1 X-RAY DIFFRACTION X-ray crystallization conditions:VAPOR DIFFUSION, HANGING DROP;pH 7.4;293 K;100 mM MES (pH 6.0), 100 mM CaCl2, 20-25% (v/v) Resolution 2.11 Å R-free 0.244

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.

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

View Construct and Data Evidence
UniProt name SNP25_RAT
Isoform P60881-2
PDB entities 3, 4
Chains and sequence ranges Author chain C; PDBConstruct 1–74; UniProt 10–83 Author chain G; PDBConstruct 1–74; UniProt 10–83 Author chain D; PDBConstruct 1–64; UniProt 141–204 Author chain H; PDBConstruct 1–64; UniProt 141–204

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 6wvw

P(r) Distance Distribution P(r) Distribution

P(r) distribution for 6wvw
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2. Structure Basics 2. Structure Basics

Entry ID entry_id6wvw
Deposition date deposition_date2020-05-07
Structure title titleCrystal structure of the R59P-SNAP25 containing SNARE complex
Keywords keywordsSNARE complex, synaptic vesicle fusion, EXOCYTOSIS; EXOCYTOSIS
Experimental Method methodX-RAY DIFFRACTION

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

Radius of gyration Rg (Guinier) rg_guinier31.86
Radius of gyration Rg (electron density) rg_electron32.05
Forward intensity I(0) i068702000.00
Molecular weight molecular_weight61013.0 kDa
Excluded volume excluded_volume74524 ų
Envelope volume envelope_volume98287 ų
Hydration-shell volume shell_volume27378 ų
Envelope diameter envelope_diameter119.0
Shell Rg shell_rg35.89
Envelope Rg envelope_rg32.80
Shape Rg shape_rg32.07
Total Rg total_rg32.30
Total atoms total_atoms8411
Residues n_residues529
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 dmax113.2
Rg (real space) rg_real32.23
Rg uncertainty (real space) rg_real_error1.09
I(0) (real space) i0_real6.8700e+07
I(0) uncertainty (real space) i0_real_error1.1080e+06
Rg (reciprocal space) rg_reciprocal32.08
I(0) (reciprocal space) i0_reciprocal68690000.0000
Solution quality estimate total_estimate0.8301
Solution quality rating solution_quality GOOD a GOOD solution
P(r) peaks n_peaks2
Primary peak position r_peak_primary34.0
Skewness Skewness skewness0.563
Kurtosis Kurtosis kurtosis-0.216
Angular range angular_range— – 0.2500 −1
Current regularization parameter α current_alpha0.0000
Highest regularization parameter α highest_alpha5452000.0000
Real-space data points n_real_points51
GNOM version gnom_version4.1.3
Quality Criteria quality_criteria AN1: 0.000; Oscil: 0.714; Stabil: 1.000; Sysdev: 1.000; Positv: 1.000; Valcen: 0.745; Smooth: 0.900

5. Crystallography and Experiment 5. Crystallography & Experiment

6. Entities and Polymers Entities & Polymers (7)

7. Fold Classification (SCOP + CATH) 9 domains

SCOP 2.08 (9 domains)

Domain ID domain_idd6wvwa_
Class classh — Coiled coil proteins
Fold Fold foldh.1 — Parallel coiled-coil
Superfamily Superfamily superfamilyh.1.15 — SNARE fusion complex
Family Family familyh.1.15.1 — SNARE fusion complex
Domain ID domain_idd6wvwb_
Class classh — Coiled coil proteins
Fold Fold foldh.1 — Parallel coiled-coil
Superfamily Superfamily superfamilyh.1.15 — SNARE fusion complex
Family Family familyh.1.15.1 — SNARE fusion complex
Domain ID domain_idd6wvwc_
Class classh — Coiled coil proteins
Fold Fold foldh.1 — Parallel coiled-coil
Superfamily Superfamily superfamilyh.1.15 — SNARE fusion complex
Family Family familyh.1.15.1 — SNARE fusion complex
Domain ID domain_idd6wvwd_
Class classh — Coiled coil proteins
Fold Fold foldh.1 — Parallel coiled-coil
Superfamily Superfamily superfamilyh.1.15 — SNARE fusion complex
Family Family familyh.1.15.1 — SNARE fusion complex
Domain ID domain_idd6wvwe1
Class classh — Coiled coil proteins
Fold Fold foldh.1 — Parallel coiled-coil
Superfamily Superfamily superfamilyh.1.15 — SNARE fusion complex
Family Family familyh.1.15.1 — SNARE fusion complex
Domain ID domain_idd6wvwe2
Class classl — Artifacts
Fold Fold foldl.1 — Tags
Superfamily Superfamily superfamilyl.1.1 — Tags
Family Family familyl.1.1.1 — Tags
Domain ID domain_idd6wvwf_
Class classh — Coiled coil proteins
Fold Fold foldh.1 — Parallel coiled-coil
Superfamily Superfamily superfamilyh.1.15 — SNARE fusion complex
Family Family familyh.1.15.1 — SNARE fusion complex
Domain ID domain_idd6wvwg_
Class classh — Coiled coil proteins
Fold Fold foldh.1 — Parallel coiled-coil
Superfamily Superfamily superfamilyh.1.15 — SNARE fusion complex
Family Family familyh.1.15.1 — SNARE fusion complex
Domain ID domain_idd6wvwh_
Class classh — Coiled coil proteins
Fold Fold foldh.1 — Parallel coiled-coil
Superfamily Superfamily superfamilyh.1.15 — SNARE fusion complex
Family Family familyh.1.15.1 — SNARE fusion complex

8. Citations (1)

9. Files and Curves (10)