1hqm

CRYSTAL STRUCTURE OF THERMUS AQUATICUS CORE RNA POLYMERASE-INCLUDES COMPLETE STRUCTURE WITH SIDE-CHAINS (EXCEPT FOR DISORDERED REGIONS)-FURTHER REFINED FROM ORIGINAL DEPOSITION-CONTAINS ADDITIONAL SEQUENCE INFORMATION

Method: X-RAY DIFFRACTION Dmax: 140.9 Å Quality: REASONABLE

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

DNA-directed RNA polymerase subunit alpha

OrganismNot specified

UniProt Q9KWU8

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 × 5 PDB declaration: pentameric(5) Consistent with protein copy count Chain A; UniProt 1–314 Chain B; UniProt 1–314 Not recorded DNA-directed RNA polymerase subunit beta × 1 (Q9KWU7) ;DNA-directed RNA polymerase subunit beta' ; × 1 (Q9KWU6) DNA-directed RNA polymerase subunit omega × 1 (Q9EVV4) MG MAGNESIUM ION × 1 ZN ZINC ION × 1 X-RAY DIFFRACTION X-ray crystallization conditions:VAPOR DIFFUSION, HANGING DROP;pH 8;298 K;ammonium sulfate, magnesium chloride, Tris-HCl, pH 8.0, VAPOR DIFFUSION, HANGING DROP, temperature 298K Resolution 3.30 Å R-free 0.360

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 20 assemblies. Open the comparison page and filter oligomeric states

View Construct and Data Evidence
UniProt name RPOA_THEAQ
Isoform
PDB entities 1
Chains and sequence ranges Author chain A; PDBConstruct 1–313; UniProt 1–314 Author chain B; PDBConstruct 1–313; UniProt 1–314

DNA-directed RNA polymerase subunit beta

OrganismNot specified

UniProt Q9KWU7

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 × 5 PDB declaration: pentameric(5) Consistent with protein copy count Chain C; UniProt 1–1119 Not recorded DNA-directed RNA polymerase subunit alpha × 2 (Q9KWU8) ;DNA-directed RNA polymerase subunit beta' ; × 1 (Q9KWU6) DNA-directed RNA polymerase subunit omega × 1 (Q9EVV4) MG MAGNESIUM ION × 1 ZN ZINC ION × 1 X-RAY DIFFRACTION X-ray crystallization conditions:VAPOR DIFFUSION, HANGING DROP;pH 8;298 K;ammonium sulfate, magnesium chloride, Tris-HCl, pH 8.0, VAPOR DIFFUSION, HANGING DROP, temperature 298K Resolution 3.30 Å R-free 0.360

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 25 assemblies. Open the comparison page and filter oligomeric states

View Construct and Data Evidence
UniProt name RPOB_THEAQ
Isoform
PDB entities 2
Chains and sequence ranges Author chain C; PDBConstruct 1–1119; UniProt 1–1119

;DNA-directed RNA polymerase subunit beta' ;

OrganismNot specified

UniProt Q9KWU6

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 × 5 PDB declaration: pentameric(5) Consistent with protein copy count Chain D; UniProt 1–155 Chain D; UniProt 452–1524 Not recorded DNA-directed RNA polymerase subunit alpha × 2 (Q9KWU8) DNA-directed RNA polymerase subunit beta × 1 (Q9KWU7) DNA-directed RNA polymerase subunit omega × 1 (Q9EVV4) MG MAGNESIUM ION × 1 ZN ZINC ION × 1 X-RAY DIFFRACTION X-ray crystallization conditions:VAPOR DIFFUSION, HANGING DROP;pH 8;298 K;ammonium sulfate, magnesium chloride, Tris-HCl, pH 8.0, VAPOR DIFFUSION, HANGING DROP, temperature 298K Resolution 3.30 Å R-free 0.360

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.

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

View Construct and Data Evidence
UniProt name RPOC_THEAQ
Isoform
PDB entities 3
Chains and sequence ranges Author chain D; PDBConstruct 1–155; UniProt 1–155 Author chain D; PDBConstruct 192–1265; UniProt 452–1524

DNA-directed RNA polymerase subunit omega

OrganismNot specified

UniProt Q9EVV4

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 × 5 PDB declaration: pentameric(5) Consistent with protein copy count Chain E; UniProt 1–99 Not recorded DNA-directed RNA polymerase subunit alpha × 2 (Q9KWU8) DNA-directed RNA polymerase subunit beta × 1 (Q9KWU7) ;DNA-directed RNA polymerase subunit beta' ; × 1 (Q9KWU6) MG MAGNESIUM ION × 1 ZN ZINC ION × 1 X-RAY DIFFRACTION X-ray crystallization conditions:VAPOR DIFFUSION, HANGING DROP;pH 8;298 K;ammonium sulfate, magnesium chloride, Tris-HCl, pH 8.0, VAPOR DIFFUSION, HANGING DROP, temperature 298K Resolution 3.30 Å R-free 0.360

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.

11 other PDB entries and 19 assemblies. Open the comparison page and filter oligomeric states

View Construct and Data Evidence
UniProt name RPOZ_THEAQ
Isoform
PDB entities 4
Chains and sequence ranges Author chain E; PDBConstruct 1–99; UniProt 1–99

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 1hqm

P(r) Distance Distribution P(r) Distribution

P(r) distribution for 1hqm
Download Download

2. Structure Basics 2. Structure Basics

Entry ID entry_id1hqm
Deposition date deposition_date2000-12-18
Structure title titleCRYSTAL STRUCTURE OF THERMUS AQUATICUS CORE RNA POLYMERASE-INCLUDES COMPLETE STRUCTURE WITH SIDE-CHAINS (EXCEPT FOR DISORDERED REGIONS)-FURTHER REFINED FROM ORIGINAL DEPOSITION-CONTAINS ADDITIONAL SEQUENCE INFORMATION
Keywords keywordsTransferase, DNA-directed RNA polymerase; TRANSFERASE
Experimental Method methodX-RAY DIFFRACTION

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

Radius of gyration Rg (Guinier) rg_guinier46.60
Radius of gyration Rg (electron density) rg_electron46.16
Forward intensity I(0) i01330010000.00
Molecular weight molecular_weight301340.0 kDa
Excluded volume excluded_volume377180 ų
Envelope volume envelope_volume549460 ų
Hydration-shell volume shell_volume95434 ų
Envelope diameter envelope_diameter234.3
Shell Rg shell_rg53.04
Envelope Rg envelope_rg48.14
Shape Rg shape_rg46.21
Total Rg total_rg46.24
Total atoms total_atoms21254
Residues n_residues2838
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 dmax140.9
Rg (real space) rg_real45.50
Rg uncertainty (real space) rg_real_error0.39
I(0) (real space) i0_real1.2800e+09
I(0) uncertainty (real space) i0_real_error2.0510e+07
Rg (reciprocal space) rg_reciprocal46.60
I(0) (reciprocal space) i0_reciprocal1330000000.0000
Solution quality estimate total_estimate0.7138
Solution quality rating solution_quality REASONABLE a REASONABLE solution
P(r) peaks n_peaks1
Primary peak position r_peak_primary58.0
Skewness Skewness skewness0.269
Kurtosis Kurtosis kurtosis-0.171
Angular range angular_range— – 0.1700 −1
Current regularization parameter α current_alpha1.9650
Highest regularization parameter α highest_alpha216500000.0000
Real-space data points n_real_points35
GNOM version gnom_version4.1.3
Quality Criteria quality_criteria AN1: 0.003; Oscil: 0.898; Stabil: 0.932; Sysdev: 0.000; Positv: 1.000; Valcen: 0.960; Smooth: 0.844

5. Crystallography and Experiment 5. Crystallography & Experiment

6. Entities and Polymers Entities & Polymers (6)

7. Fold Classification (SCOP + CATH) 19 domains

SCOP 2.08 (5 domains)

Domain ID domain_idd1hqma_
Class classi — Low resolution protein structures
Fold Fold foldi.8 — RNA polymerase
Superfamily Superfamily superfamilyi.8.1 — RNA polymerase
Family Family familyi.8.1.1 — RNA polymerase
Domain ID domain_idd1hqmb_
Class classi — Low resolution protein structures
Fold Fold foldi.8 — RNA polymerase
Superfamily Superfamily superfamilyi.8.1 — RNA polymerase
Family Family familyi.8.1.1 — RNA polymerase
Domain ID domain_idd1hqmc_
Class classi — Low resolution protein structures
Fold Fold foldi.8 — RNA polymerase
Superfamily Superfamily superfamilyi.8.1 — RNA polymerase
Family Family familyi.8.1.1 — RNA polymerase
Domain ID domain_idd1hqmd_
Class classi — Low resolution protein structures
Fold Fold foldi.8 — RNA polymerase
Superfamily Superfamily superfamilyi.8.1 — RNA polymerase
Family Family familyi.8.1.1 — RNA polymerase
Domain ID domain_idd1hqme_
Class classi — Low resolution protein structures
Fold Fold foldi.8 — RNA polymerase
Superfamily Superfamily superfamilyi.8.1 — RNA polymerase
Family Family familyi.8.1.1 — RNA polymerase

CATH v4.4 (14 domains)

Domain ID domain_id1hqmA01
Class class3 — Alpha Beta
Architecture architecture30 — 2-Layer Sandwich
Topology topology1360 — Gyrase A; domain 2
Homologous superfamily homologous superfamily10 — RNA polymerase, RBP11-like subunit
Domain ID domain_id1hqmA02
Class class2 — Mainly Beta
Architecture architecture170 — Beta Complex
Topology topology120 — RNA Polymerase Alpha Subunit; Chain A, domain 2
Homologous superfamily homologous superfamily12 — DNA-directed RNA polymerase, insert domain
Domain ID domain_id1hqmB01
Class class3 — Alpha Beta
Architecture architecture30 — 2-Layer Sandwich
Topology topology1360 — Gyrase A; domain 2
Homologous superfamily homologous superfamily10 — RNA polymerase, RBP11-like subunit
Domain ID domain_id1hqmB02
Class class2 — Mainly Beta
Architecture architecture170 — Beta Complex
Topology topology120 — RNA Polymerase Alpha Subunit; Chain A, domain 2
Homologous superfamily homologous superfamily12 — DNA-directed RNA polymerase, insert domain
Domain ID domain_id1hqmC01
Class class2 — Mainly Beta
Architecture architecture40 — Beta Barrel
Topology topology270 — Dna-directed Rna Polymerase Ii 140kd Polypeptide; Chain: B; Domain 6
Homologous superfamily homologous superfamily10 — DNA-directed RNA polymerase, subunit 2, domain 6
Domain ID domain_id1hqmC02
Class class3 — Alpha Beta
Architecture architecture90 — Alpha-Beta Complex
Topology topology1100 — Rna Polymerase Beta Subunit; Chain: C,domain 2
Homologous superfamily homologous superfamily10
Domain ID domain_id1hqmC03
Class class3 — Alpha Beta
Architecture architecture90 — Alpha-Beta Complex
Topology topology1110 — Dna-directed Rna Polymerase Ii 140kd Polypeptide; Chain: B; domain 3
Homologous superfamily homologous superfamily10 — RNA polymerase Rpb2, domain 2
Domain ID domain_id1hqmC04
Class class2 — Mainly Beta
Architecture architecture30 — Roll
Topology topology150 — Rna Polymerase Beta Subunit; Chain: C, domain 4
Homologous superfamily homologous superfamily10 — DNA-directed RNA polymerase, beta subunit, external 1 domain
Domain ID domain_id1hqmC05
Class class2 — Mainly Beta
Architecture architecture40 — Beta Barrel
Topology topology50 — OB fold (Dihydrolipoamide Acetyltransferase, E2P)
Homologous superfamily homologous superfamily100 — RNA polymerase II/Efflux pump adaptor protein, barrel-sandwich hybrid domain
Domain ID domain_id1hqmC06
Class class2 — Mainly Beta
Architecture architecture40 — Beta Barrel
Topology topology50 — OB fold (Dihydrolipoamide Acetyltransferase, E2P)
Homologous superfamily homologous superfamily150 — RNA polymerase II, Rpb2 subunit, wall domain
Domain ID domain_id1hqmD02
Class class1 — Mainly Alpha
Architecture architecture10 — Orthogonal Bundle
Topology topology274 — Enzyme I; Chain A, domain 2
Homologous superfamily homologous superfamily100 — RNA polymerase Rpb1, domain 3
Domain ID domain_id1hqmD03
Class class1 — Mainly Alpha
Architecture architecture10 — Orthogonal Bundle
Topology topology132 — Topoisomerase I; Chain A, domain 4
Homologous superfamily homologous superfamily30 — RNA polymerase Rpb1 funnel domain
Domain ID domain_id1hqmD05
Class class3 — Alpha Beta
Architecture architecture90 — Alpha-Beta Complex
Topology topology105 — Molybdopterin biosynthesis moea protein, domain 2
Homologous superfamily homologous superfamily10 — Molybdopterin biosynthesis moea protein, domain 2
Domain ID domain_id1hqmE00
Class class3 — Alpha Beta
Architecture architecture90 — Alpha-Beta Complex
Topology topology940 — Eukaryotic RPB6 RNA polymerase subunit
Homologous superfamily homologous superfamily10 — RNA polymerase subunit, RPB6/omega

8. Citations (1)

9. Files and Curves (10)