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MolNFT v1 · #127279 · protein + DNA + RNA

Pseudo-atomic model of the RNA polymerase lambda-based antitermination complex solved by cryo-EM

5MS0 · Antitermination protein N: “Pseudo-atomic model of the RNA polymerase lambda-based antitermination complex solved by cryo-EM”. Electron microscopy, 2 ligands (ZN, MG), 20 pockets (best druggability 0.83). MolNFT v1 #127279 on…

PDB
5MS0
Type
protein + DNA + RNA
Length
4,253 residues
Chains
14
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Antitermination protein N; Nascent RNA; DNA-directed RNA polymerase subunit alpha…
EC
2.7.7.6
UniProt
P03045, P0A7Z4, P0A8V2, P0A8T7, P0A7R5, P0AFG0, P0A780, P0AFF6, P0A800
Ligands
ZN, MG
Pockets
20 · best druggability 0.83

Structure

electron microscopy · 13 distinct chains · 27% helix, 15% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
NAntitermination protein Nprotein8546% helix, 0% strandP03045
RNascent RNArna29——
A, BDNA-directed RNA polymerase subunit alpha (EC 2.7.7.6)protein23515% helix, 28% strandP0A7Z4
CDNA-directed RNA polymerase subunit beta (EC 2.7.7.6)protein129124% helix, 16% strandP0A8V2
DDNA-directed RNA polymerase subunit beta' (EC 2.7.7.6)protein136424% helix, 11% strandP0A8T7
E30S ribosomal protein S10protein10026% helix, 32% strandP0A7R5
FTranscription TERMINATION/ANTITERMINATION protein nusgprotein18114% helix, 20% strandP0AFG0
HRNA transcription bubblerna14——
IDnaidna27——
JDnaiidna39——
LTranscription antitermination protein nusbprotein13962% helix, 0% strandP0A780
MTranscription TERMINATION/ANTITERMINATION protein nusaprotein42539% helix, 16% strandP0AFF6
ODNA-directed RNA polymerase subunit omega (EC 2.7.7.6)protein8939% helix, 0% strandP0A800

Ligands and binding sites

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

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
111230.830.84151empty
24810.820.8987empty
39650.820.84110empty
44220.820.9081empty
56580.810.8689empty

Interfaces

29 interfaces between chains.

  • C–D · 3264 Ų buried · 13 hydrogen bonds · protein-protein
  • I–J · 1238 Ų buried · 100 hydrogen bonds · nucleic-nucleic
  • N–M · 792 Ų buried · 0 hydrogen bonds · protein-protein
  • D–O · 761 Ų buried · 2 hydrogen bonds · protein-protein
  • D–J · 758 Ų buried · 22 hydrogen bonds · protein-nucleic

Compared structures

  • 5MS0 · pseudo-atomic model of the RNA polymerase lambda-based antitermination complex solved by… · the same entry in another collection · chain O against O, TM-score 1.00

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