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MolNFT v1 · #171657 · protein

Structure of the B. subtilis RNA polymerase in complex with held (monomer)

6ZCA · Probable DNA-directed RNA polymerase subunit DELTA,PROBABLE…: “Structure of the B. subtilis RNA polymerase in complex with held (monomer)”. Electron microscopy, 1 ligand (ZN), 20 pockets (best druggability 0.85). MolNFT v1 #171657…

PDB
6ZCA
Type
protein
Length
3,640 residues
Chains
7
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Probable DNA-directed RNA polymerase subunit DELTA,PROBABLE DNA-directed RNA polymerase…
EC
2.7.7.6, 3.6.4.12
UniProt
A0A0D1KIU7, A0A410WI33, A0A063XB83, A0A2J0WBQ0, A0A063XB23, A0A164TSE8
Ligands
ZN
Pockets
20 · best druggability 0.85

Structure

electron microscopy · 7 distinct chains · 36% helix, 15% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
DProbable DNA-directed RNA polymerase subunit DELTA,PROBABLE DNA-directed RNA polymerase subunit DELTA,PROBABLE DNA-directed RNA polymerase subunit deltaprotein14057% helix, 4% strandA0A0D1KIU7
ERNA polymerase subunit omegaprotein6922% helix, 20% strandA0A410WI33
UDNA-directed RNA polymerase subunit alpha (EC 2.7.7.6)protein23126% helix, 28% strandA0A063XB83
VDNA-directed RNA polymerase subunit alpha (EC 2.7.7.6)protein22724% helix, 21% strandA0A063XB83
XDNA-directed RNA polymerase subunit beta (EC 2.7.7.6)protein107526% helix, 24% strandA0A2J0WBQ0
YDNA-directed RNA polymerase subunit beta' (EC 2.7.7.6)protein112741% helix, 10% strandA0A063XB23
HDNA helicase (EC 3.6.4.12)protein77148% helix, 8% strandA0A164TSE8

Ligands and binding sites

  • ZN · Zinc ion · metal · chains Y

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
18350.850.88115empty
24920.830.9064empty
36960.820.8687empty
44940.820.8862empty
511040.810.82124empty

Interfaces

14 interfaces between chains.

  • X–Y · 5166 Ų buried · 30 hydrogen bonds · protein-protein
  • Y–H · 4327 Ų buried · 38 hydrogen bonds · protein-protein
  • U–V · 1867 Ų buried · 5 hydrogen bonds · protein-protein
  • U–X · 1792 Ų buried · 17 hydrogen bonds · protein-protein
  • D–Y · 1346 Ų buried · 4 hydrogen bonds · protein-protein

Compared structures

  • 6ZCA · Structure of the B. subtilis RNA POLYMERASE in complex with HelD (monomer) · the same entry in another collection · chain D against D, TM-score 1.00

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