2gum

Crystal structure of the extracellular domain of glycoprotein B from Herpes Simplex Virus type I

Method: X-RAY DIFFRACTION Dmax: 160.7 Å Quality: GOOD

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

Glycoprotein B

Human herpesvirus 1

UniProt P06437

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 × 3 PDB declaration: trimeric(3) Consistent with protein copy count Chain A; UniProt 103–730 Chain B; UniProt 103–730 Chain C; UniProt 103–730 Fragment:residues 103-730 NA SODIUM ION × 4 X-RAY DIFFRACTION X-ray crystallization conditions:VAPOR DIFFUSION, HANGING DROP;pH 7;298 K;8% PEG 6000, 0.1 M Na Hepes, 15% 2-methyl-2,4-pentanediol, pH 7.0, VAPOR DIFFUSION, HANGING DROP, temperature 298K Resolution 2.10 Å R-free 0.275

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.

12 other PDB entries and 30 assemblies. Open the comparison page and filter oligomeric states

View Construct and Data Evidence
UniProt name VGLB_HHV1K
Isoform
PDB entities 1
Chains and sequence ranges Author chain A; PDBConstruct 1–628; UniProt 103–730 Author chain B; PDBConstruct 1–628; UniProt 103–730 Author chain C; PDBConstruct 1–628; UniProt 103–730

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 2gum

P(r) Distance Distribution P(r) Distribution

P(r) distribution for 2gum
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2. Structure Basics 2. Structure Basics

Entry ID entry_id2gum
Deposition date deposition_date2006-05-01
Structure title titleCrystal structure of the extracellular domain of glycoprotein B from Herpes Simplex Virus type I
Keywords keywordsENVELOPE GLYCOPROTEIN, MEMBRANE FUSION, VIRAL PROTEIN; VIRAL PROTEIN
Experimental Method methodX-RAY DIFFRACTION

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

Radius of gyration Rg (Guinier) rg_guinier50.56
Radius of gyration Rg (electron density) rg_electron50.93
Forward intensity I(0) i0599537000.00
Molecular weight molecular_weight198520.0 kDa
Excluded volume excluded_volume246500 ų
Envelope volume envelope_volume352540 ų
Hydration-shell volume shell_volume62296 ų
Envelope diameter envelope_diameter172.0
Shell Rg shell_rg48.23
Envelope Rg envelope_rg50.33
Shape Rg shape_rg50.91
Total Rg total_rg50.86
Total atoms total_atoms14000
Residues n_residues1732
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 dmax160.7
Rg (real space) rg_real50.98
Rg uncertainty (real space) rg_real_error1.49
I(0) (real space) i0_real5.9950e+08
I(0) uncertainty (real space) i0_real_error1.1290e+07
Rg (reciprocal space) rg_reciprocal50.20
I(0) (reciprocal space) i0_reciprocal598900000.0000
Solution quality estimate total_estimate0.7752
Solution quality rating solution_quality GOOD a GOOD solution
P(r) peaks n_peaks3
Primary peak position r_peak_primary41.5
Skewness Skewness skewness0.552
Kurtosis Kurtosis kurtosis-0.530
Angular range angular_range— – 0.1550 −1
Current regularization parameter α current_alpha0.0000
Highest regularization parameter α highest_alpha56570000.0000
Real-space data points n_real_points32
GNOM version gnom_version4.1.3
Quality Criteria quality_criteria AN1: 0.000; Oscil: 0.752; Stabil: 0.999; Sysdev: 1.000; Positv: 1.000; Valcen: 0.812; Smooth: 0.007

5. Crystallography and Experiment 5. Crystallography & Experiment

6. Entities and Polymers Entities & Polymers (3)

7. Fold Classification (SCOP + CATH) 15 domains

SCOP 2.08 (3 domains)

Domain ID domain_idd2guma1
Class classe — Multi-domain proteins (alpha and beta)
Fold Fold folde.76 — Viral glycoprotein ectodomain-like
Superfamily Superfamily superfamilye.76.1 — Viral glycoprotein ectodomain-like
Family Family familye.76.1.1 — Glycoprotein B-like
Domain ID domain_idd2gumb_
Class classe — Multi-domain proteins (alpha and beta)
Fold Fold folde.76 — Viral glycoprotein ectodomain-like
Superfamily Superfamily superfamilye.76.1 — Viral glycoprotein ectodomain-like
Family Family familye.76.1.1 — Glycoprotein B-like
Domain ID domain_idd2gumc_
Class classe — Multi-domain proteins (alpha and beta)
Fold Fold folde.76 — Viral glycoprotein ectodomain-like
Superfamily Superfamily superfamilye.76.1 — Viral glycoprotein ectodomain-like
Family Family familye.76.1.1 — Glycoprotein B-like

CATH v4.4 (12 domains)

Domain ID domain_id2gumA01
Class class2 — Mainly Beta
Architecture architecture30 — Roll
Topology topology30 — SH3 type barrels.
Homologous superfamily homologous superfamily1230
Domain ID domain_id2gumA02
Class class1 — Mainly Alpha
Architecture architecture20 — Up-down Bundle
Topology topology5 — Single alpha-helices involved in coiled-coils or other helix-helix interfaces
Homologous superfamily homologous superfamily1890
Domain ID domain_id2gumA03
Class class2 — Mainly Beta
Architecture architecture30 — Roll
Topology topology29 — PH-domain like
Homologous superfamily homologous superfamily100
Domain ID domain_id2gumA05
Class class6 — Special
Architecture architecture10 — Helix non-globular
Topology topology250 — Single alpha-helices involved in coiled-coils or other helix-helix interfaces
Homologous superfamily homologous superfamily3280
Domain ID domain_id2gumB01
Class class2 — Mainly Beta
Architecture architecture30 — Roll
Topology topology30 — SH3 type barrels.
Homologous superfamily homologous superfamily1230
Domain ID domain_id2gumB02
Class class1 — Mainly Alpha
Architecture architecture20 — Up-down Bundle
Topology topology5 — Single alpha-helices involved in coiled-coils or other helix-helix interfaces
Homologous superfamily homologous superfamily1890
Domain ID domain_id2gumB03
Class class2 — Mainly Beta
Architecture architecture30 — Roll
Topology topology29 — PH-domain like
Homologous superfamily homologous superfamily100
Domain ID domain_id2gumB05
Class class6 — Special
Architecture architecture10 — Helix non-globular
Topology topology250 — Single alpha-helices involved in coiled-coils or other helix-helix interfaces
Homologous superfamily homologous superfamily3280
Domain ID domain_id2gumC01
Class class2 — Mainly Beta
Architecture architecture30 — Roll
Topology topology30 — SH3 type barrels.
Homologous superfamily homologous superfamily1230
Domain ID domain_id2gumC02
Class class1 — Mainly Alpha
Architecture architecture20 — Up-down Bundle
Topology topology5 — Single alpha-helices involved in coiled-coils or other helix-helix interfaces
Homologous superfamily homologous superfamily1890
Domain ID domain_id2gumC03
Class class2 — Mainly Beta
Architecture architecture30 — Roll
Topology topology29 — PH-domain like
Homologous superfamily homologous superfamily100
Domain ID domain_id2gumC05
Class class6 — Special
Architecture architecture10 — Helix non-globular
Topology topology250 — Single alpha-helices involved in coiled-coils or other helix-helix interfaces
Homologous superfamily homologous superfamily3280

8. Citations (1)

9. Files and Curves (10)