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MolNFT v1 · #153150 · protein + DNA + RNA

RNA polymerase II elongation complex bound with SPT4/5 and foreign DNA, stalled at shl(-1) of the nucleosome, weak ELF1 (+1 position)

6J51 · DNA-directed RNA polymerase subunit: “RNA polymerase II elongation complex bound with SPT4/5 and foreign DNA, stalled at shl(-1) of the nucleosome…”. Electron microscopy, 2 ligands (ZN, MG), 20 pockets (best druggability 0.88).…

PDB
6J51
Type
protein + DNA + RNA
Length
5,459 residues
Chains
28
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
DNA-directed RNA polymerase subunit; DNA-directed RNA polymerase subunit beta; RNA…
EC
2.7.7.6
UniProt
C4R4Y0, C4QZQ7, C4R7L2, C4R2U9, C4R3P8, C4R1V1, C4R9A1, C4R273, F2QPE6, C4R009, C4R3Z5, F2QMI1, C4QZ45, C4R0E6, C4R370, P84243, P62805, P04908, P06899
Ligands
ZN, MG
Pockets
20 · best druggability 0.88

Structure

electron microscopy · 28 distinct chains · 36% helix, 21% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ADNA-directed RNA polymerase subunit (EC 2.7.7.6)protein141142% helix, 17% strandC4R4Y0
BDNA-directed RNA polymerase subunit beta (EC 2.7.7.6)protein115727% helix, 25% strandC4QZQ7
CRNA polymerase II third largest subunit B44, part of central coreprotein26325% helix, 30% strandC4R7L2
DRNA polymerase II subunit B32protein16851% helix, 8% strandC4R2U9
ERNA polymerase subunit ABC27, common to RNA polymerases I, II, and IIIprotein21340% helix, 24% strandC4R3P8
FRNA polymerase subunit ABC23, common to RNA polymerases I, II, and IIIprotein8435% helix, 17% strandC4R1V1
GRNA polymerase II subunitprotein17113% helix, 49% strandC4R9A1
HDNA-directed RNA polymerases I, II, and III subunit RPABC3protein1338% helix, 49% strandC4R273
IDNA-directed RNA polymerase subunitprotein1113% helix, 32% strandF2QPE6
JRNA polymerase subunit ABC10-beta, common to RNA polymerases I, II, and IIIprotein6644% helix, 5% strandC4R009
KRNA polymerase II subunit B12.5protein11341% helix, 24% strandC4R3Z5
LRNA polymerase subunit ABC10-alphaprotein450% helix, 29% strandF2QMI1
PRNA (5'- R(P*CP*CP*UP*GP*GP*UP*GP*UP*CP*UP*UP*GP*GP*GP*UP*G)-3')rna16——
TDNA (198-mer)dna127——
NDNA (198-mer)dna122——
MTranscription elongation factor 1 homologprotein6419% helix, 36% strandC4QZ45
VTranscription elongation factor SPT4protein10230% helix, 22% strandC4R0E6
WProtein that forms a complex with SPT4Pprotein27519% helix, 32% strandC4R370
aHistone H3.3protein9764% helix, 3% strandP84243
bHistone H4protein8064% helix, 5% strandP62805
cHistone H2A type 1-B/Eprotein10357% helix, 3% strandP04908
dHistone H2B type 1-Jprotein9573% helix, 2% strandP06899
eHistone H3.3protein9763% helix, 3% strandP84243
fHistone H4protein7865% helix, 5% strandP62805
gHistone H2A type 1-B/Eprotein10552% helix, 5% strandP04908
hHistone H2B type 1-Jprotein9178% helix, 4% strandP06899
0DNA (36-mer)dna36——
1DNA (36-mer)dna36——

Ligands and binding sites

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

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
17700.880.91101empty
29130.850.8788empty
39670.840.8590empty
49610.840.85115empty
57210.830.8763empty

Interfaces

90 interfaces between chains.

  • A–B · 10138 Ų buried · 109 hydrogen bonds · protein-protein
  • T–N · 5338 Ų buried · 539 hydrogen bonds · nucleic-nucleic
  • a–b · 2481 Ų buried · 16 hydrogen bonds · protein-protein
  • c–d · 2457 Ų buried · 14 hydrogen bonds · protein-protein
  • e–f · 2419 Ų buried · 11 hydrogen bonds · protein-protein

Compared structures

  • 6J51 · RNA polymerase II elongation complex bound with Spt4/5 and foreign DNA, stalled at… · the same entry in another collection · chain B against B, TM-score 1.00

Analyse

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