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MolNFT v1 · #144859 · protein + DNA + RNA

Cryoem structure of E.COLI RNA polymerase elongation complex bound with rfah

6C6T · DNA (29-mer): “Cryoem structure of E.COLI RNA polymerase elongation complex bound with rfah”. Electron microscopy, 2 ligands (ZN, MG), 20 pockets (best druggability 0.84). MolNFT v1 #144859 on GenesisL1: 3D structure, binding sites…

PDB
6C6T
Type
protein + DNA + RNA
Length
3,330 residues
Chains
9
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
DNA (29-mer); RNA (5'- R(*GP*CP*AP*UP*UP*CP*AP*AP*AP*GP*CP*CP*GP*AP*GP*AP*GP*GP*UP*A)-3')…
EC
2.7.7.6
UniProt
P0A7Z4, P0A8V2, P0A8T7, P0A800, P0AFW0
Ligands
ZN, MG
Pockets
20 · best druggability 0.84

Structure

electron microscopy · 9 distinct chains · 31% helix, 21% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ADNA (29-mer)dna29——
BDNA (29-mer)dna29——
RRNA (5'- R(*GP*CP*AP*UP*UP*CP*AP*AP*AP*GP*CP*CP*GP*AP*GP*AP*GP*GP*UP*A)-3')rna10——
GDNA-directed RNA polymerase subunit alpha (EC 2.7.7.6)protein22122% helix, 36% strandP0A7Z4
HDNA-directed RNA polymerase subunit alpha (EC 2.7.7.6)protein21920% helix, 39% strandP0A7Z4
IDNA-directed RNA polymerase subunit beta (EC 2.7.7.6)protein131929% helix, 22% strandP0A8V2
JDNA-directed RNA polymerase subunit beta' (EC 2.7.7.6)protein133535% helix, 16% strandP0A8T7
KDNA-directed RNA polymerase subunit omega (EC 2.7.7.6)protein8364% helix, 0% strandP0A800
DTranscription antitermination protein rfahprotein8524% helix, 27% strandP0AFW0

Ligands and binding sites

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

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
19750.840.8595empty
29780.830.8479empty
39330.830.8587empty
45720.800.8668empty
510610.800.8194empty

Interfaces

19 interfaces between chains.

  • I–J · 8300 Ų buried · 90 hydrogen bonds · protein-protein
  • G–H · 1884 Ų buried · 12 hydrogen bonds · protein-protein
  • G–I · 1882 Ų buried · 19 hydrogen bonds · protein-protein
  • J–K · 1274 Ų buried · 15 hydrogen bonds · protein-protein
  • B–J · 1106 Ų buried · 11 hydrogen bonds · protein-nucleic

Compared structures

  • 6C6T · CryoEM structure of E.coli RNA polymerase elongation complex bound with RfaH · the same entry in another collection · chain D against D, 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 I against A, TM-score 0.99
  • P0AFW0 · AlphaFold monomer V2.0 prediction for transcription antitermination protein rfah (P0AFW0) · a predicted model of the same protein · chain D against A, TM-score 0.95

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