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Crystal structure of a transcribing RNA polymerase II complex reveals a complete transcription bubble

Analyse Crystal structure of a transcribing RNA polymerase II complex reveals a… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5C3E
Type
protein + DNA + RNA
Length
4,025 residues
Chains
15
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
DNA-directed RNA polymerase II subunit RPB1; DNA-directed RNA polymerase II subunit RPB2…
EC
2.7.7.6
UniProt
P04050, P08518, P16370, P20433, P20434, P20435, P34087, P20436, P27999, P22139, P38902, P40422
Ligands
ZN, MG
Pockets
20 · best druggability 0.87

Structure

x-ray diffraction · 15 distinct chains · 30% helix, 20% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ADNA-directed RNA polymerase II subunit RPB1 (EC 2.7.7.6)protein143038% helix, 15% strandP04050
BDNA-directed RNA polymerase II subunit RPB2 (EC 2.7.7.6)protein115727% helix, 21% strandP08518
CDNA-directed RNA polymerase II subunit RPB3protein26523% helix, 20% strandP16370
DDNA-directed RNA polymerase II subunit RPB4protein17848% helix, 3% strandP20433
EDNA-directed RNA polymerases I, II, and III subunit RPABC1protein21435% helix, 22% strandP20434
FDNA-directed RNA polymerases I, II, and III subunit RPABC2protein8730% helix, 16% strandP20435
GDNA-directed RNA polymerase II subunit RPB7protein17110% helix, 45% strandP34087
HDNA-directed RNA polymerases I, II, and III subunit RPABC3protein1350% helix, 44% strandP20436
IDNA-directed RNA polymerase II subunit RPB9protein1143% helix, 26% strandP27999
JDNA-directed RNA polymerases I, II, and III subunit RPABC5protein6644% helix, 2% strandP22139
KDNA-directed RNA polymerase II subunit RPB11protein11538% helix, 23% strandP38902
LDNA-directed RNA polymerases I, II, and III subunit RPABC4protein430% helix, 16% strandP40422
RSynthetic RNArna9——
SSynthetic DNAdna14——
USynthetic DNAdna27——

Ligands and binding sites

  • ZN · Zinc ion · metal · 9 copies · chains A, B, C, I, J, L
  • MG · Magnesium ion · metal · 2 copies · chains A, 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
17740.870.90102empty
210220.830.8488empty
310620.820.8390empty
44870.810.8857empty
57620.800.8482empty

Interfaces

39 interfaces between chains.

  • A–B · 9920 Ų buried · 152 hydrogen bonds · protein-protein
  • D–G · 2474 Ų buried · 31 hydrogen bonds · protein-protein
  • A–E · 2336 Ų buried · 34 hydrogen bonds · protein-protein
  • A–F · 2288 Ų buried · 21 hydrogen bonds · protein-protein
  • C–K · 2134 Ų buried · 18 hydrogen bonds · protein-protein

Compared structures

  • 5C3E · Crystal structure of a transcribing RNA Polymerase II complex reveals a complete… · the same entry in another collection · chain A against A, TM-score 1.00

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