3hu2

Structure of p97 N-D1 R86A mutant in complex with ATPgS

Method: X-RAY DIFFRACTION Dmax: 164.7 Å Quality: GOOD

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

Transitional endoplasmic reticulum ATPase

Homo sapiens

UniProt P55072

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 × 6 PDB declaration: hexameric(6) Consistent with protein copy count Chain A; UniProt 1–481 Chain B; UniProt 1–481 Chain C; UniProt 1–481 Chain D; UniProt 1–481 Chain E; UniProt 1–481 Chain F; UniProt 1–481 Fragment:residues 1-481 Mutation:R86G AGS PHOSPHOTHIOPHOSPHORIC ACID-ADENYLATE ESTER × 6 MG MAGNESIUM ION × 6 X-RAY DIFFRACTION X-ray crystallization conditions:VAPOR DIFFUSION, HANGING DROP;pH 5.8;288 K;100mM NaCl, 4% benzamidine, 100mM citrate, pH 5.8, 16.5% PEG3350 and 20% glycerol, VAPOR DIFFUSION, HANGING DROP, temperature 288K Resolution 2.85 Å R-free 0.290

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.

143 other PDB entries and 156 assemblies. Open the comparison page and filter oligomeric states

View Construct and Data Evidence
UniProt name TERA_HUMAN
Isoform
PDB entities 1
Chains and sequence ranges Author chain A; PDBConstruct 1–481; UniProt 1–481 Author chain B; PDBConstruct 1–481; UniProt 1–481 Author chain C; PDBConstruct 1–481; UniProt 1–481 Author chain D; PDBConstruct 1–481; UniProt 1–481 Author chain E; PDBConstruct 1–481; UniProt 1–481 Author chain F; PDBConstruct 1–481; UniProt 1–481

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 3hu2

P(r) Distance Distribution P(r) Distribution

P(r) distribution for 3hu2
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2. Structure Basics 2. Structure Basics

Entry ID entry_id3hu2
Deposition date deposition_date2009-06-12
Structure title titleStructure of p97 N-D1 R86A mutant in complex with ATPgS
Keywords keywordsp97, VCP, TRANSPORT PROTEIN; TRANSPORT PROTEIN
Experimental Method methodX-RAY DIFFRACTION

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

Radius of gyration Rg (Guinier) rg_guinier51.83
Radius of gyration Rg (electron density) rg_electron51.69
Forward intensity I(0) i01368610000.00
Molecular weight molecular_weight304960.0 kDa
Excluded volume excluded_volume380540 ų
Envelope volume envelope_volume565590 ų
Hydration-shell volume shell_volume87763 ų
Envelope diameter envelope_diameter166.8
Shell Rg shell_rg58.46
Envelope Rg envelope_rg50.65
Shape Rg shape_rg51.70
Total Rg total_rg51.84
Total atoms total_atoms21360
Residues n_residues2712
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 dmax164.7
Rg (real space) rg_real51.73
Rg uncertainty (real space) rg_real_error1.74
I(0) (real space) i0_real1.3690e+09
I(0) uncertainty (real space) i0_real_error2.7120e+07
Rg (reciprocal space) rg_reciprocal51.90
I(0) (reciprocal space) i0_reciprocal1369000000.0000
Solution quality estimate total_estimate0.8961
Solution quality rating solution_quality GOOD a GOOD solution
P(r) peaks n_peaks2
Primary peak position r_peak_primary60.4
Skewness Skewness skewness0.157
Kurtosis Kurtosis kurtosis-0.698
Angular range angular_range— – 0.1500 −1
Current regularization parameter α current_alpha0.0000
Highest regularization parameter α highest_alpha99280000.0000
Real-space data points n_real_points31
GNOM version gnom_version4.1.3
Quality Criteria quality_criteria AN1: 0.000; Oscil: 0.957; Stabil: 1.000; Sysdev: 1.000; Positv: 1.000; Valcen: 0.996; Smooth: 0.778

5. Crystallography and Experiment 5. Crystallography & Experiment

6. Entities and Polymers Entities & Polymers (4)

7. Fold Classification (SCOP + CATH) 42 domains

SCOP 2.08 (18 domains)

Domain ID domain_idd3hu2a1
Class classb — All beta proteins
Fold Fold foldb.52 — Double psi beta-barrel
Superfamily Superfamily superfamilyb.52.2 — ADC-like
Family Family familyb.52.2.0 — automated matches
Domain ID domain_idd3hu2a2
Class classd — Alpha and beta proteins (a+b)
Fold Fold foldd.31 — Cdc48 domain 2-like
Superfamily Superfamily superfamilyd.31.1 — Cdc48 domain 2-like
Family Family familyd.31.1.0 — automated matches
Domain ID domain_idd3hu2a3
Class classc — Alpha and beta proteins (a/b)
Fold Fold foldc.37 — P-loop containing nucleoside triphosphate hydrolases
Superfamily Superfamily superfamilyc.37.1 — P-loop containing nucleoside triphosphate hydrolases
Family Family familyc.37.1.20 — Extended AAA-ATPase domain
Domain ID domain_idd3hu2b1
Class classb — All beta proteins
Fold Fold foldb.52 — Double psi beta-barrel
Superfamily Superfamily superfamilyb.52.2 — ADC-like
Family Family familyb.52.2.0 — automated matches
Domain ID domain_idd3hu2b2
Class classd — Alpha and beta proteins (a+b)
Fold Fold foldd.31 — Cdc48 domain 2-like
Superfamily Superfamily superfamilyd.31.1 — Cdc48 domain 2-like
Family Family familyd.31.1.0 — automated matches
Domain ID domain_idd3hu2b3
Class classc — Alpha and beta proteins (a/b)
Fold Fold foldc.37 — P-loop containing nucleoside triphosphate hydrolases
Superfamily Superfamily superfamilyc.37.1 — P-loop containing nucleoside triphosphate hydrolases
Family Family familyc.37.1.20 — Extended AAA-ATPase domain
Domain ID domain_idd3hu2c1
Class classb — All beta proteins
Fold Fold foldb.52 — Double psi beta-barrel
Superfamily Superfamily superfamilyb.52.2 — ADC-like
Family Family familyb.52.2.0 — automated matches
Domain ID domain_idd3hu2c2
Class classd — Alpha and beta proteins (a+b)
Fold Fold foldd.31 — Cdc48 domain 2-like
Superfamily Superfamily superfamilyd.31.1 — Cdc48 domain 2-like
Family Family familyd.31.1.0 — automated matches
Domain ID domain_idd3hu2c3
Class classc — Alpha and beta proteins (a/b)
Fold Fold foldc.37 — P-loop containing nucleoside triphosphate hydrolases
Superfamily Superfamily superfamilyc.37.1 — P-loop containing nucleoside triphosphate hydrolases
Family Family familyc.37.1.20 — Extended AAA-ATPase domain
Domain ID domain_idd3hu2d1
Class classb — All beta proteins
Fold Fold foldb.52 — Double psi beta-barrel
Superfamily Superfamily superfamilyb.52.2 — ADC-like
Family Family familyb.52.2.0 — automated matches
Domain ID domain_idd3hu2d2
Class classd — Alpha and beta proteins (a+b)
Fold Fold foldd.31 — Cdc48 domain 2-like
Superfamily Superfamily superfamilyd.31.1 — Cdc48 domain 2-like
Family Family familyd.31.1.0 — automated matches
Domain ID domain_idd3hu2d3
Class classc — Alpha and beta proteins (a/b)
Fold Fold foldc.37 — P-loop containing nucleoside triphosphate hydrolases
Superfamily Superfamily superfamilyc.37.1 — P-loop containing nucleoside triphosphate hydrolases
Family Family familyc.37.1.20 — Extended AAA-ATPase domain
Domain ID domain_idd3hu2e1
Class classb — All beta proteins
Fold Fold foldb.52 — Double psi beta-barrel
Superfamily Superfamily superfamilyb.52.2 — ADC-like
Family Family familyb.52.2.0 — automated matches
Domain ID domain_idd3hu2e2
Class classd — Alpha and beta proteins (a+b)
Fold Fold foldd.31 — Cdc48 domain 2-like
Superfamily Superfamily superfamilyd.31.1 — Cdc48 domain 2-like
Family Family familyd.31.1.0 — automated matches
Domain ID domain_idd3hu2e3
Class classc — Alpha and beta proteins (a/b)
Fold Fold foldc.37 — P-loop containing nucleoside triphosphate hydrolases
Superfamily Superfamily superfamilyc.37.1 — P-loop containing nucleoside triphosphate hydrolases
Family Family familyc.37.1.20 — Extended AAA-ATPase domain
Domain ID domain_idd3hu2f1
Class classb — All beta proteins
Fold Fold foldb.52 — Double psi beta-barrel
Superfamily Superfamily superfamilyb.52.2 — ADC-like
Family Family familyb.52.2.0 — automated matches
Domain ID domain_idd3hu2f2
Class classd — Alpha and beta proteins (a+b)
Fold Fold foldd.31 — Cdc48 domain 2-like
Superfamily Superfamily superfamilyd.31.1 — Cdc48 domain 2-like
Family Family familyd.31.1.0 — automated matches
Domain ID domain_idd3hu2f3
Class classc — Alpha and beta proteins (a/b)
Fold Fold foldc.37 — P-loop containing nucleoside triphosphate hydrolases
Superfamily Superfamily superfamilyc.37.1 — P-loop containing nucleoside triphosphate hydrolases
Family Family familyc.37.1.20 — Extended AAA-ATPase domain

CATH v4.4 (24 domains)

Domain ID domain_id3hu2A01
Class class2 — Mainly Beta
Architecture architecture40 — Beta Barrel
Topology topology40 — Barwin-like endoglucanases
Homologous superfamily homologous superfamily20
Domain ID domain_id3hu2A02
Class class3 — Alpha Beta
Architecture architecture10 — Roll
Topology topology330 — Vcp-like ATPase; Chain A, domain 2
Homologous superfamily homologous superfamily10
Domain ID domain_id3hu2A03
Class class3 — Alpha Beta
Architecture architecture40 — 3-Layer(aba) Sandwich
Topology topology50 — Rossmann fold
Homologous superfamily homologous superfamily300 — P-loop containing nucleotide triphosphate hydrolases
Domain ID domain_id3hu2A04
Class class1 — Mainly Alpha
Architecture architecture10 — Orthogonal Bundle
Topology topology8 — Helicase, Ruva Protein; domain 3
Homologous superfamily homologous superfamily60
Domain ID domain_id3hu2B01
Class class2 — Mainly Beta
Architecture architecture40 — Beta Barrel
Topology topology40 — Barwin-like endoglucanases
Homologous superfamily homologous superfamily20
Domain ID domain_id3hu2B02
Class class3 — Alpha Beta
Architecture architecture10 — Roll
Topology topology330 — Vcp-like ATPase; Chain A, domain 2
Homologous superfamily homologous superfamily10
Domain ID domain_id3hu2B03
Class class3 — Alpha Beta
Architecture architecture40 — 3-Layer(aba) Sandwich
Topology topology50 — Rossmann fold
Homologous superfamily homologous superfamily300 — P-loop containing nucleotide triphosphate hydrolases
Domain ID domain_id3hu2B04
Class class1 — Mainly Alpha
Architecture architecture10 — Orthogonal Bundle
Topology topology8 — Helicase, Ruva Protein; domain 3
Homologous superfamily homologous superfamily60
Domain ID domain_id3hu2C01
Class class2 — Mainly Beta
Architecture architecture40 — Beta Barrel
Topology topology40 — Barwin-like endoglucanases
Homologous superfamily homologous superfamily20
Domain ID domain_id3hu2C02
Class class3 — Alpha Beta
Architecture architecture10 — Roll
Topology topology330 — Vcp-like ATPase; Chain A, domain 2
Homologous superfamily homologous superfamily10
Domain ID domain_id3hu2C03
Class class3 — Alpha Beta
Architecture architecture40 — 3-Layer(aba) Sandwich
Topology topology50 — Rossmann fold
Homologous superfamily homologous superfamily300 — P-loop containing nucleotide triphosphate hydrolases
Domain ID domain_id3hu2C04
Class class1 — Mainly Alpha
Architecture architecture10 — Orthogonal Bundle
Topology topology8 — Helicase, Ruva Protein; domain 3
Homologous superfamily homologous superfamily60
Domain ID domain_id3hu2D01
Class class2 — Mainly Beta
Architecture architecture40 — Beta Barrel
Topology topology40 — Barwin-like endoglucanases
Homologous superfamily homologous superfamily20
Domain ID domain_id3hu2D02
Class class3 — Alpha Beta
Architecture architecture10 — Roll
Topology topology330 — Vcp-like ATPase; Chain A, domain 2
Homologous superfamily homologous superfamily10
Domain ID domain_id3hu2D03
Class class3 — Alpha Beta
Architecture architecture40 — 3-Layer(aba) Sandwich
Topology topology50 — Rossmann fold
Homologous superfamily homologous superfamily300 — P-loop containing nucleotide triphosphate hydrolases
Domain ID domain_id3hu2D04
Class class1 — Mainly Alpha
Architecture architecture10 — Orthogonal Bundle
Topology topology8 — Helicase, Ruva Protein; domain 3
Homologous superfamily homologous superfamily60
Domain ID domain_id3hu2E01
Class class2 — Mainly Beta
Architecture architecture40 — Beta Barrel
Topology topology40 — Barwin-like endoglucanases
Homologous superfamily homologous superfamily20
Domain ID domain_id3hu2E02
Class class3 — Alpha Beta
Architecture architecture10 — Roll
Topology topology330 — Vcp-like ATPase; Chain A, domain 2
Homologous superfamily homologous superfamily10
Domain ID domain_id3hu2E03
Class class3 — Alpha Beta
Architecture architecture40 — 3-Layer(aba) Sandwich
Topology topology50 — Rossmann fold
Homologous superfamily homologous superfamily300 — P-loop containing nucleotide triphosphate hydrolases
Domain ID domain_id3hu2E04
Class class1 — Mainly Alpha
Architecture architecture10 — Orthogonal Bundle
Topology topology8 — Helicase, Ruva Protein; domain 3
Homologous superfamily homologous superfamily60
Domain ID domain_id3hu2F01
Class class2 — Mainly Beta
Architecture architecture40 — Beta Barrel
Topology topology40 — Barwin-like endoglucanases
Homologous superfamily homologous superfamily20
Domain ID domain_id3hu2F02
Class class3 — Alpha Beta
Architecture architecture10 — Roll
Topology topology330 — Vcp-like ATPase; Chain A, domain 2
Homologous superfamily homologous superfamily10
Domain ID domain_id3hu2F03
Class class3 — Alpha Beta
Architecture architecture40 — 3-Layer(aba) Sandwich
Topology topology50 — Rossmann fold
Homologous superfamily homologous superfamily300 — P-loop containing nucleotide triphosphate hydrolases
Domain ID domain_id3hu2F04
Class class1 — Mainly Alpha
Architecture architecture10 — Orthogonal Bundle
Topology topology8 — Helicase, Ruva Protein; domain 3
Homologous superfamily homologous superfamily60

8. Citations (1)

9. Files and Curves (10)