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RNA polymerase II core pre-initiation complex with closed promoter DNA in proximal position

Analyse RNA polymerase II core pre-initiation complex with closed promoter DNA in… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7NVS
Type
protein + DNA
Length
5,347 residues
Chains
22
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
RPB1; DNA-directed RNA polymerase subunit beta; DNA-directed RNA polymerase II subunit…
EC
2.7.7.6, 2.3.1.48, 3.6.4.12
UniProt
I3LGP4, I3LCH3, A0A287ADR4, I3LSI7, F1SKN8, I3LJZ9, A0A4X1ULF2, P60899, A0A4X1VYD0, A0A4X1UK25, I3LN51, Q00403, P20226, P35269, P13984, P52655, P52657, P29083, P29084
Ligands
ZN, MG
Pockets
20 · best druggability 0.87

Structure

electron microscopy · 22 distinct chains · 36% helix, 23% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ARPB1protein142343% helix, 15% strand—
BDNA-directed RNA polymerase subunit beta (EC 2.7.7.6)protein113629% helix, 25% strandI3LGP4
CDNA-directed RNA polymerase II subunit RPB3protein25725% helix, 28% strandI3LCH3
DRPOL4C domain-containing proteinprotein12862% helix, 2% strandA0A287ADR4
EDNA-directed RNA polymerase II subunit Eprotein20939% helix, 24% strandI3LSI7
FDNA-directed RNA polymerase II subunit Fprotein7938% helix, 16% strandF1SKN8
GDNA-directed RNA polymerase II subunit RPB7protein1719% helix, 51% strandI3LJZ9
HDNA-directed RNA polymerases I, II, and III subunit RPABC3protein1485% helix, 47% strandA0A4X1ULF2
IDNA-directed RNA polymerase II subunit RPB9protein1148% helix, 34% strandP60899
JDNA-directed RNA polymerases I, II, and III subunit RPABC5protein6444% helix, 5% strandA0A4X1VYD0
KRNA_POL_L_2 domain-containing proteinprotein11542% helix, 23% strandA0A4X1UK25
LRNA polymerase II subunit Kprotein440% helix, 27% strandI3LN51
MTranscription initiation factor iib (EC 2.3.1.48)protein25258% helix, 4% strandQ00403
NNon-template DNAdna49——
OTata-box-binding proteinprotein17927% helix, 34% strandP20226
QGeneral transcription factor iif subunit 1protein13816% helix, 37% strandP35269
RGeneral transcription factor iif subunit 2 (EC 3.6.4.12)protein22235% helix, 28% strandP13984
TTemplate DNAdna49——
UTranscription initiation factor iia subunit 1protein11336% helix, 33% strandP52655
VTranscription initiation factor iia subunit 2protein9937% helix, 36% strandP52657
WGeneral transcription factor iie subunit 1protein18759% helix, 17% strandP29083
XTranscription initiation factor iie subunit betaprotein17150% helix, 12% strandP29084

Ligands and binding sites

  • ZN · Zinc ion · metal · 10 copies · chains A, B, C, I, J, L, M, W
  • MG · Magnesium ion · metal · chains A

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
111590.870.88119empty
210580.830.85123empty
311700.830.84149empty
411780.830.8487empty
58000.810.8487empty

Interfaces

57 interfaces between chains.

  • A–B · 8893 Ų buried · 129 hydrogen bonds · protein-protein
  • U–V · 2776 Ų buried · 37 hydrogen bonds · protein-protein
  • Q–R · 2388 Ų buried · 41 hydrogen bonds · protein-protein
  • A–E · 2333 Ų buried · 29 hydrogen bonds · protein-protein
  • C–K · 2301 Ų buried · 18 hydrogen bonds · protein-protein

Compared structures

  • 7NVS · RNA polymerase II core pre-initiation complex with closed promoter DNA in proximal… · the same entry in another collection · chain I against I, TM-score 1.00

Analyse

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