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MolNFT v1 · #183913 · protein + DNA

Yeast RNA polymerase II transcription pre-initiation complex with open promoter DNA

7O75 · General transcription and DNA repair factor iih helicase…: “Yeast RNA polymerase II transcription pre-initiation complex with open promoter DNA”. Electron microscopy, 5 ligands (SF4, BEF, ADP), 20 pockets (best druggability 0.88).…

PDB
7O75
Type
protein + DNA
Length
9,028 residues
Chains
30
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
General transcription and DNA repair factor iih helicase subunit xpd; General…
EC
3.6.4.12
UniProt
P06839, P32776, Q02939, Q03290, Q12004, Q3E7C1, Q04673, Q00578, P04050, P08518, P16370, P20433, P20434, P20435, P34087, P20436, P27999, P22139, P38902, P40422, P29055, P13393, P41895, P41896, P32773, P32774, P36100, P36145
Ligands
SF4, BEF, ADP, ZN, MG
Pockets
20 · best druggability 0.88

Structure

electron microscopy · 30 distinct chains · 39% helix, 20% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
0General transcription and DNA repair factor iih helicase subunit xpdprotein75251% helix, 14% strandP06839
1General transcription and DNA repair factor iih subunit TFB1protein52255% helix, 10% strandP32776
2General transcription and DNA repair factor iih subunit TFB2protein44552% helix, 13% strandQ02939
3RNA polymerase II transcription factor B subunit 3protein13147% helix, 10% strandQ03290
4General transcription and DNA repair factor iih subunit TFB4protein29339% helix, 17% strandQ12004
5General transcription and DNA repair factor iih subunit TFB5protein6543% helix, 23% strandQ3E7C1
6General transcription and DNA repair factor iih subunit SSL1protein37432% helix, 19% strandQ04673
7General transcription and DNA repair factor iih helicase subunit xpb (EC 3.6.4.12)protein61540% helix, 18% strandQ00578
ADNA-directed RNA polymerase II subunit RPB1protein143042% helix, 17% strandP04050
BDNA-directed RNA polymerase II subunit RPB2protein118028% helix, 26% strandP08518
CDNA-directed RNA polymerase II subunit RPB3protein26626% helix, 29% strandP16370
DDNA-directed RNA polymerase II subunit RPB4protein16757% helix, 7% strandP20433
EDNA-directed RNA polymerases I, II, and III subunit RPABC1protein21442% helix, 23% strandP20434
FDNA-directed RNA polymerases I, II, and III subunit RPABC2protein8635% helix, 16% strandP20435
GDNA-directed RNA polymerase II subunit RPB7protein17112% helix, 51% strandP34087
HDNA-directed RNA polymerases I, II, and III subunit RPABC3protein1403% helix, 50% strandP20436
IDNA-directed RNA polymerase II subunit RPB9protein1163% helix, 31% strandP27999
JDNA-directed RNA polymerases I, II, and III subunit RPABC5protein6942% helix, 4% strandP22139
KDNA-directed RNA polymerase II subunit RPB11protein11539% helix, 23% strandP38902
LDNA-directed RNA polymerases I, II, and III subunit RPABC4protein450% helix, 36% strandP40422
MTranscription initiation factor iibprotein30856% helix, 6% strandP29055
NNon-template DNAdna64——
OTata-box-binding proteinprotein18126% helix, 36% strandP13393
QTranscription initiation factor iif subunit alphaprotein21827% helix, 22% strandP41895
RTranscription initiation factor iif subunit beta (EC 3.6.4.12)protein26828% helix, 23% strandP41896
TTemplate DNAdna63——
UTranscription initiation factor iia large subunitprotein10739% helix, 36% strandP32773
VTranscription initiation factor iia subunit 2protein10439% helix, 38% strandP32774
WTranscription initiation factor iie subunit alphaprotein31251% helix, 11% strandP36100
XTranscription initiation factor iie subunit betaprotein20740% helix, 11% strandP36145

Ligands and binding sites

  • SF4 · Iron/sulfur cluster · ligand · chains 0
  • BEF · Beryllium trifluoride ion · ligand · chains 7
  • ADP · Adenosine-5'-diphosphate · ligand · chains 7
  • ZN · Zinc ion · metal · 17 copies · chains 3, 4, 6, A, B, C, I, J, L, M, W
  • MG · Magnesium ion · metal · 2 copies · chains 7, 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
110390.880.90137empty
211500.850.86132empty
311030.850.85117empty
411110.840.85108empty
52290.830.9633empty

Interfaces

99 interfaces between chains.

  • A–B · 9984 Ų buried · 141 hydrogen bonds · protein-protein
  • 0–1 · 4134 Ų buried · 49 hydrogen bonds · protein-protein
  • Q–R · 3506 Ų buried · 65 hydrogen bonds · protein-protein
  • 1–4 · 3150 Ų buried · 22 hydrogen bonds · protein-protein
  • B–Q · 3016 Ų buried · 27 hydrogen bonds · protein-protein

Compared structures

  • 7O75 · Yeast RNA polymerase II transcription pre-initiation complex with open promoter DNA · the same entry in another collection · chain C against C, TM-score 1.00

Analyse

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