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MolNFT v1 · #162754 · protein + DNA + RNA

Cryo-EM structure of E. COLI RNA polymerase backtracked elongation complex in non-swiveled state

6RI9 · Non-template DNA: “Cryo-EM structure of E. COLI RNA polymerase backtracked elongation complex in non-swiveled state”. Electron microscopy, 2 ligands (ZN, MG), 20 pockets (best druggability 0.84). MolNFT v1 #162754 on GenesisL1: 3D…

PDB
6RI9
Type
protein + DNA + RNA
Length
3,250 residues
Chains
8
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Non-template DNA; Template DNA; DNA-directed RNA polymerase subunit alpha; DNA-directed…
EC
2.7.7.6
UniProt
P0A7Z4, P0A8V2, P0A8T7, P0A800
Ligands
ZN, MG
Pockets
20 · best druggability 0.84

Structure

electron microscopy · 8 distinct chains · 33% helix, 19% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
NNon-template DNAdna22——
TTemplate DNAdna30——
ADNA-directed RNA polymerase subunit alpha (EC 2.7.7.6)protein22824% helix, 30% strandP0A7Z4
BDNA-directed RNA polymerase subunit alpha (EC 2.7.7.6)protein22921% helix, 33% strandP0A7Z4
CDNA-directed RNA polymerase subunit beta (EC 2.7.7.6)protein131931% helix, 21% strandP0A8V2
DDNA-directed RNA polymerase subunit beta' (EC 2.7.7.6)protein133638% helix, 15% strandP0A8T7
EDNA-directed RNA polymerase subunit omega (EC 2.7.7.6)protein7359% helix, 0% strandP0A800
RRNArna13——

Ligands and binding sites

  • ZN · Zinc ion · metal · 2 copies · chains D
  • MG · Magnesium ion · metal · chains D, R

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Pockets

20 pockets found on a 1 Å grid, 20 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15390.840.9063empty
29330.830.8597empty
38340.820.8496empty
49350.810.8388empty
58720.800.83110empty

Interfaces

15 interfaces between chains.

  • C–D · 8124 Ų buried · 76 hydrogen bonds · protein-protein
  • A–B · 1959 Ų buried · 11 hydrogen bonds · protein-protein
  • A–C · 1866 Ų buried · 17 hydrogen bonds · protein-protein
  • D–E · 1280 Ų buried · 9 hydrogen bonds · protein-protein
  • B–D · 1028 Ų buried · 10 hydrogen bonds · protein-protein

Compared structures

  • 6RI9 · Cryo-EM structure of E. coli RNA polymerase backtracked elongation complex in… · the same entry in another collection · chain R against R, TM-score 1.00
  • P0A8V2 · AlphaFold monomer V2.0 prediction for DNA-directed RNA polymerase subunit beta (P0A8V2) · a predicted model of the same protein · chain C against A, TM-score 0.99

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