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MolNFT v1 · #156504 · protein + DNA + RNA

Cryoem structure of thermus thermophilus RNA polymerase elongation complex

6M6C · DNA-directed RNA polymerase subunit alpha: “Cryoem structure of thermus thermophilus RNA polymerase elongation complex”. Electron microscopy, 2 ligands (ZN, MG), 20 pockets (best druggability 0.85). MolNFT v1 #156504 on GenesisL1…

PDB
6M6C
Type
protein + DNA + RNA
Length
3,017 residues
Chains
8
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
DNA-directed RNA polymerase subunit alpha; DNA-directed RNA polymerase subunit beta…
EC
2.7.7.6
UniProt
Q5SHR6, Q8RQE9, Q8RQE8, Q8RQE7
Ligands
ZN, MG
Pockets
20 · best druggability 0.85

Structure

electron microscopy · 8 distinct chains · 34% helix, 25% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ADNA-directed RNA polymerase subunit alpha (EC 2.7.7.6)protein22621% helix, 38% strandQ5SHR6
BDNA-directed RNA polymerase subunit alpha (EC 2.7.7.6)protein22223% helix, 42% strandQ5SHR6
CDNA-directed RNA polymerase subunit beta (EC 2.7.7.6)protein111129% helix, 27% strandQ8RQE9
DDNA-directed RNA polymerase subunit beta' (EC 2.7.7.6)protein130541% helix, 19% strandQ8RQE8
EDNA-directed RNA polymerase subunit omega (EC 2.7.7.6)protein9452% helix, 12% strandQ8RQE7
RRNArna10——
NNontemplate strand DNAdna20——
TTemplate strand DNAdna29——

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
19410.850.8696empty
24610.810.8957empty
38320.810.8481empty
47020.790.8468empty
55130.780.8565empty

Interfaces

17 interfaces between chains.

  • C–D · 8988 Ų buried · 98 hydrogen bonds · protein-protein
  • D–E · 2516 Ų buried · 31 hydrogen bonds · protein-protein
  • A–C · 2060 Ų buried · 25 hydrogen bonds · protein-protein
  • A–B · 1524 Ų buried · 6 hydrogen bonds · protein-protein
  • B–D · 1228 Ų buried · 15 hydrogen bonds · protein-protein

Compared structures

  • 6M6C · CryoEM structure of Thermus thermophilus RNA polymerase elongation complex · the same entry in another collection · chain T against T, TM-score 1.00
  • Q8RQE7 · AlphaFold monomer V2.0 prediction for DNA-directed RNA polymerase subunit omega (Q8RQE7) · a predicted model of the same protein · chain E against A, TM-score 0.98

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