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MolNFT v1 · #184377 · protein + DNA + RNA

Pol II-csb-csa-DDB1-uvssa-ADPBEF3 (STRUCTURE2)

7OOB · DNA-directed RNA polymerase II subunit RPB1: “Pol II-csb-csa-DDB1-uvssa-ADPBEF3 (STRUCTURE2)”. Electron microscopy, 4 ligands (ADP, BEF, ZN), 20 pockets (best druggability 0.87). MolNFT v1 #184377 on GenesisL1: 3D structure, binding…

PDB
7OOB
Type
protein + DNA + RNA
Length
5,642 residues
Chains
18
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
DNA-directed RNA polymerase II subunit RPB1; DNA-directed RNA polymerase subunit beta…
EC
2.7.7.6, 3.6.4.-
UniProt
P11414, I3LGP4, I3LCH3, A0A287ADR4, I3LSI7, F1SKN8, I3LJZ9, A0A4X1ULF2, P60899, A0A4X1VYD0, A0A4X1UK25, I3LN51, Q03468, Q16531, Q13216
Ligands
ADP, BEF, ZN, MG
Pockets
20 · best druggability 0.87

Structure

electron microscopy · 18 distinct chains · 29% helix, 27% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ADNA-directed RNA polymerase II subunit RPB1protein141242% helix, 16% strandP11414
BDNA-directed RNA polymerase subunit beta (EC 2.7.7.6)protein113129% helix, 25% strandI3LGP4
CDNA-directed RNA polymerase II subunit RPB3protein26025% helix, 28% strandI3LCH3
DRPOL4C domain-containing proteinprotein12658% helix, 3% strandA0A287ADR4
EDNA-directed RNA polymerase II subunit Eprotein20942% helix, 25% strandI3LSI7
FDNA-directed RNA polymerase II subunit Fprotein8233% helix, 16% strandF1SKN8
GDNA-directed RNA polymerase II subunit RPB7protein1719% helix, 51% strandI3LJZ9
HDNA-directed RNA polymerases I, II, and III subunit RPABC3protein1485% helix, 49% strandA0A4X1ULF2
IDNA-directed RNA polymerase II subunit RPB9protein1174% helix, 30% strandP60899
JDNA-directed RNA polymerases I, II, and III subunit RPABC5protein6742% helix, 4% strandA0A4X1VYD0
KRNA_POL_L_2 domain-containing proteinprotein11542% helix, 23% strandA0A4X1UK25
LRNA polymerase II subunit Kprotein460% helix, 26% strandI3LN51
bDNA excision repair protein ercc-6 (EC 3.6.4.-)protein52048% helix, 12% strandQ03468
dDNA damage-binding protein 1protein7818% helix, 51% strandQ16531
NNtsdna35——
TTsdna47——
PRNArna10——
aDNA excision repair protein ercc-8protein3656% helix, 43% strandQ13216

Ligands and binding sites

  • ADP · Adenosine-5'-diphosphate · ligand · chains b
  • BEF · Beryllium trifluoride ion · ligand · chains b
  • ZN · Zinc ion · metal · 8 copies · chains A, B, C, I, J, L
  • MG · Magnesium ion · metal · 2 copies · chains A, P, b

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
16940.870.9288empty
210950.850.86138empty
33880.850.9445empty
45670.830.8868empty
54420.830.9047empty

Interfaces

41 interfaces between chains.

  • A–B · 9099 Ų buried · 128 hydrogen bonds · protein-protein
  • d–a · 2552 Ų buried · 36 hydrogen bonds · protein-protein
  • A–E · 2415 Ų buried · 29 hydrogen bonds · protein-protein
  • C–K · 2281 Ų buried · 21 hydrogen bonds · protein-protein
  • A–H · 2159 Ų buried · 30 hydrogen bonds · protein-protein

Compared structures

  • 7OOB · Pol II-CSB-CSA-DDB1-UVSSA-ADPBeF3 (Structure2) · the same entry in another collection · chain a against a, TM-score 1.00

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