5d4e

Crystal structure of Thermus thermophilus product complex for transcription initiation with 3'-dephosphate-CoA and CTP

Method: X-RAY DIFFRACTION
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1. Protein Identity and Related Structures Protein Identity & Related Structures

DNA-directed RNA polymerase subunit alpha

OrganismNot specified

UniProt Q9Z9H6

State in the Current Structure

Assembly Physical composition Protein state Molecular copy count Associated components Data consistency
1 Protein–DNA Heteromer Protein 6 DNA 2 DNA-directed RNA polymerase subunit beta × 1 (Q8RQE9) ;DNA-directed RNA polymerase subunit beta' ; × 1 (Q8RQE8) DNA-directed RNA polymerase subunit omega × 1 (Q8RQE7) RNA polymerase sigma factor SigA × 1 (Q72L95) DNA (27-MER) × 1 ;DNA (5'-D(*CP*C*TP*GP*CP*AP*TP*CP*CP*GP*TP*GP*AP*GP*TP*AP*GP*AP*G)-3') ; × 1 MAGNESIUM ION × 5 ZINC ION × 2 CYTIDINE-5'-MONOPHOSPHATE × 1 DIPHOSPHATE × 1 DEPHOSPHO COENZYME A × 1 water × 8 Consistent with all polymers
2 Protein–DNA Heteromer Protein 6 DNA 2 DNA-directed RNA polymerase subunit beta × 1 (Q8RQE9) ;DNA-directed RNA polymerase subunit beta' ; × 1 (Q8RQE8) DNA-directed RNA polymerase subunit omega × 1 (Q8RQE7) RNA polymerase sigma factor SigA × 1 (Q72L95) DNA (27-MER) × 1 ;DNA (5'-D(*CP*C*TP*GP*CP*AP*TP*CP*CP*GP*TP*GP*AP*GP*TP*AP*GP*AP*G)-3') ; × 1 MAGNESIUM ION × 4 ZINC ION × 2 CYTIDINE-5'-MONOPHOSPHATE × 1 DIPHOSPHATE × 1 DEPHOSPHO COENZYME A × 1 water × 8 Consistent with all polymers

Other States of the Same Protein in the Database

View Construct and Data Evidence
UniProt name RPOA_THETH
Isoform —
PDB entities 1
Chains and sequence ranges Author chain A; PDBConstruct 1–315; UniProt 1–315 Author chain B; PDBConstruct 1–315; UniProt 1–315 Author chain K; PDBConstruct 1–315; UniProt 1–315 Author chain L; PDBConstruct 1–315; UniProt 1–315

DNA-directed RNA polymerase subunit beta

OrganismNot specified

UniProt Q8RQE9

State in the Current Structure

Assembly Physical composition Protein state Molecular copy count Associated components Data consistency
1 Protein–DNA Heteromer Protein 6 DNA 2 DNA-directed RNA polymerase subunit alpha × 2 (Q9Z9H6) ;DNA-directed RNA polymerase subunit beta' ; × 1 (Q8RQE8) DNA-directed RNA polymerase subunit omega × 1 (Q8RQE7) RNA polymerase sigma factor SigA × 1 (Q72L95) DNA (27-MER) × 1 ;DNA (5'-D(*CP*C*TP*GP*CP*AP*TP*CP*CP*GP*TP*GP*AP*GP*TP*AP*GP*AP*G)-3') ; × 1 MAGNESIUM ION × 5 ZINC ION × 2 CYTIDINE-5'-MONOPHOSPHATE × 1 DIPHOSPHATE × 1 DEPHOSPHO COENZYME A × 1 water × 8 Consistent with all polymers
2 Protein–DNA Heteromer Protein 6 DNA 2 DNA-directed RNA polymerase subunit alpha × 2 (Q9Z9H6) ;DNA-directed RNA polymerase subunit beta' ; × 1 (Q8RQE8) DNA-directed RNA polymerase subunit omega × 1 (Q8RQE7) RNA polymerase sigma factor SigA × 1 (Q72L95) DNA (27-MER) × 1 ;DNA (5'-D(*CP*C*TP*GP*CP*AP*TP*CP*CP*GP*TP*GP*AP*GP*TP*AP*GP*AP*G)-3') ; × 1 MAGNESIUM ION × 4 ZINC ION × 2 CYTIDINE-5'-MONOPHOSPHATE × 1 DIPHOSPHATE × 1 DEPHOSPHO COENZYME A × 1 water × 8 Consistent with all polymers

Other States of the Same Protein in the Database

View Construct and Data Evidence
UniProt name RPOB_THET8
Isoform —
PDB entities 2
Chains and sequence ranges Author chain C; PDBConstruct 1–1119; UniProt 1–1119 Author chain M; PDBConstruct 1–1119; UniProt 1–1119

;DNA-directed RNA polymerase subunit beta' ;

OrganismNot specified

UniProt Q8RQE8

State in the Current Structure

Assembly Physical composition Protein state Molecular copy count Associated components Data consistency
1 Protein–DNA Heteromer Protein 6 DNA 2 DNA-directed RNA polymerase subunit alpha × 2 (Q9Z9H6) DNA-directed RNA polymerase subunit beta × 1 (Q8RQE9) DNA-directed RNA polymerase subunit omega × 1 (Q8RQE7) RNA polymerase sigma factor SigA × 1 (Q72L95) DNA (27-MER) × 1 ;DNA (5'-D(*CP*C*TP*GP*CP*AP*TP*CP*CP*GP*TP*GP*AP*GP*TP*AP*GP*AP*G)-3') ; × 1 MAGNESIUM ION × 5 ZINC ION × 2 CYTIDINE-5'-MONOPHOSPHATE × 1 DIPHOSPHATE × 1 DEPHOSPHO COENZYME A × 1 water × 8 Consistent with all polymers
2 Protein–DNA Heteromer Protein 6 DNA 2 DNA-directed RNA polymerase subunit alpha × 2 (Q9Z9H6) DNA-directed RNA polymerase subunit beta × 1 (Q8RQE9) DNA-directed RNA polymerase subunit omega × 1 (Q8RQE7) RNA polymerase sigma factor SigA × 1 (Q72L95) DNA (27-MER) × 1 ;DNA (5'-D(*CP*C*TP*GP*CP*AP*TP*CP*CP*GP*TP*GP*AP*GP*TP*AP*GP*AP*G)-3') ; × 1 MAGNESIUM ION × 4 ZINC ION × 2 CYTIDINE-5'-MONOPHOSPHATE × 1 DIPHOSPHATE × 1 DEPHOSPHO COENZYME A × 1 water × 8 Consistent with all polymers

Other States of the Same Protein in the Database

View Construct and Data Evidence
UniProt name RPOC_THET8
Isoform —
PDB entities 3
Chains and sequence ranges Author chain D; PDBConstruct 1–1524; UniProt 1–1524 Author chain N; PDBConstruct 1–1524; UniProt 1–1524

DNA-directed RNA polymerase subunit omega

OrganismNot specified

UniProt Q8RQE7

State in the Current Structure

Assembly Physical composition Protein state Molecular copy count Associated components Data consistency
1 Protein–DNA Heteromer Protein 6 DNA 2 DNA-directed RNA polymerase subunit alpha × 2 (Q9Z9H6) DNA-directed RNA polymerase subunit beta × 1 (Q8RQE9) ;DNA-directed RNA polymerase subunit beta' ; × 1 (Q8RQE8) RNA polymerase sigma factor SigA × 1 (Q72L95) DNA (27-MER) × 1 ;DNA (5'-D(*CP*C*TP*GP*CP*AP*TP*CP*CP*GP*TP*GP*AP*GP*TP*AP*GP*AP*G)-3') ; × 1 MAGNESIUM ION × 5 ZINC ION × 2 CYTIDINE-5'-MONOPHOSPHATE × 1 DIPHOSPHATE × 1 DEPHOSPHO COENZYME A × 1 water × 8 Consistent with all polymers
2 Protein–DNA Heteromer Protein 6 DNA 2 DNA-directed RNA polymerase subunit alpha × 2 (Q9Z9H6) DNA-directed RNA polymerase subunit beta × 1 (Q8RQE9) ;DNA-directed RNA polymerase subunit beta' ; × 1 (Q8RQE8) RNA polymerase sigma factor SigA × 1 (Q72L95) DNA (27-MER) × 1 ;DNA (5'-D(*CP*C*TP*GP*CP*AP*TP*CP*CP*GP*TP*GP*AP*GP*TP*AP*GP*AP*G)-3') ; × 1 MAGNESIUM ION × 4 ZINC ION × 2 CYTIDINE-5'-MONOPHOSPHATE × 1 DIPHOSPHATE × 1 DEPHOSPHO COENZYME A × 1 water × 8 Consistent with all polymers

Other States of the Same Protein in the Database

View Construct and Data Evidence
UniProt name RPOZ_THET8
Isoform —
PDB entities 4
Chains and sequence ranges Author chain E; PDBConstruct 1–99; UniProt 1–99 Author chain O; PDBConstruct 1–99; UniProt 1–99

RNA polymerase sigma factor SigA

Thermus thermophilus (strain HB27 / ATCC BAA-163 / DSM 7039)

UniProt Q72L95

State in the Current Structure

Assembly Physical composition Protein state Molecular copy count Associated components Data consistency
1 Protein–DNA Heteromer Protein 6 DNA 2 DNA-directed RNA polymerase subunit alpha × 2 (Q9Z9H6) DNA-directed RNA polymerase subunit beta × 1 (Q8RQE9) ;DNA-directed RNA polymerase subunit beta' ; × 1 (Q8RQE8) DNA-directed RNA polymerase subunit omega × 1 (Q8RQE7) DNA (27-MER) × 1 ;DNA (5'-D(*CP*C*TP*GP*CP*AP*TP*CP*CP*GP*TP*GP*AP*GP*TP*AP*GP*AP*G)-3') ; × 1 MAGNESIUM ION × 5 ZINC ION × 2 CYTIDINE-5'-MONOPHOSPHATE × 1 DIPHOSPHATE × 1 DEPHOSPHO COENZYME A × 1 water × 8 Consistent with all polymers
2 Protein–DNA Heteromer Protein 6 DNA 2 DNA-directed RNA polymerase subunit alpha × 2 (Q9Z9H6) DNA-directed RNA polymerase subunit beta × 1 (Q8RQE9) ;DNA-directed RNA polymerase subunit beta' ; × 1 (Q8RQE8) DNA-directed RNA polymerase subunit omega × 1 (Q8RQE7) DNA (27-MER) × 1 ;DNA (5'-D(*CP*C*TP*GP*CP*AP*TP*CP*CP*GP*TP*GP*AP*GP*TP*AP*GP*AP*G)-3') ; × 1 MAGNESIUM ION × 4 ZINC ION × 2 CYTIDINE-5'-MONOPHOSPHATE × 1 DIPHOSPHATE × 1 DEPHOSPHO COENZYME A × 1 water × 8 Consistent with all polymers

Other States of the Same Protein in the Database

View Construct and Data Evidence
UniProt name SIGA_THET2
Isoform —
PDB entities 5
Chains and sequence ranges Author chain F; PDBConstruct 21–443; UniProt 1–423 Author chain P; PDBConstruct 21–443; UniProt 1–423

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.

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2. Structure Basics 2. Structure Basics

Entry ID entry_id5d4e
Deposition date deposition_date2015-08-07
Structure title titleCrystal structure of Thermus thermophilus product complex for transcription initiation with 3'-dephosphate-CoA and CTP
Keywords keywords;Coenzyme A, RNA polymerase, transcription initiation, bacterial, NCIN, non-canonical initiating nucleotide, 3'-dephosphate-coenzyme A, primer-dependent initiation, DNA, Single-Stranded, DNA-Directed RNA Polymerases, Gene Expression Regulation, Promoter Regions, Genetic, Protein Conformation, Sigma Factor, transcription-dna complex ;; transcription/dna
Experimental Method methodX-RAY DIFFRACTION
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3. Official assembly/model SAXS Official SAXS Profiles

This page reads only the latest assembly calculations. Every curve maps to an explicit PDB entry, official biological assembly and coordinate model.

5d4e__assembly_1__model_1

Assembly 1 · Model 1 · CRYSOL 4.1.3-1-20251215 (887e7ef)

Download this curve (.dat)

5d4e__assembly_1__model_1 | I(q)

10-2 10-1 106 107 108 109 q (1/Angstrom) I(q)
100 plotted points; both axes use logarithmic scales.

5d4e__assembly_1__model_1 | P(r) · Pending

The new assembly/model P(r) has not been calculated yet This placeholder does not display legacy data r (Angstrom) P(r)
P(r) will be calculated and displayed separately for the same assembly/model.
Rg(Guinier)52.04 Å
Rg (electron density)52.85 Å
Total Rg52.83 Å
Atom count28470
Residues3529
Excluded volume506180 ų
Maximum q0.500 Å⁻¹
Assembly Model Structure unit Oligomeric description Status CRYSOL Actions
1 1 5d4e__assembly_1__model_1 octameric (8) Success 4.1.3-1-20251215 (887e7ef) View Download
2 1 5d4e__assembly_2__model_1 octameric (8) Success 4.1.3-1-20251215 (887e7ef) View Download
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4. Crystallography and Experiment 4. Crystallography & Experiment

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5. Entities and Polymers Entities & Polymers (13)

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6. Fold Classification (SCOP + CATH) 25 domains

CATH v4.4 (25 domains)

Domain ID domain_id5d4eA01
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_id5d4eA02
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_id5d4eB01
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_id5d4eB02
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_id5d4eC01
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_id5d4eC03
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_id5d4eC04
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_id5d4eC05
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_id5d4eC06
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_id5d4eD01
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_id5d4eD02
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_id5d4eE00
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
Domain ID domain_id5d4eF02
Class class1 — Mainly Alpha
Architecture architecture10 — Orthogonal Bundle
Topology topology10 — Arc Repressor Mutant, subunit A
Homologous superfamily homologous superfamily10 — Winged helix-like DNA-binding domain superfamily/Winged helix DNA-binding domain
Domain ID domain_id5d4eK01
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_id5d4eK02
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_id5d4eL01
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_id5d4eL02
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_id5d4eM01
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_id5d4eM03
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_id5d4eM04
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_id5d4eM05
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_id5d4eM06
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_id5d4eN01
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_id5d4eO00
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
Domain ID domain_id5d4eP02
Class class1 — Mainly Alpha
Architecture architecture10 — Orthogonal Bundle
Topology topology10 — Arc Repressor Mutant, subunit A
Homologous superfamily homologous superfamily10 — Winged helix-like DNA-binding domain superfamily/Winged helix DNA-binding domain
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7. Citations (1)