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MolNFT v1 · #177365 · protein + DNA

Tfiid-based core pic on puma promoter

7EG8 · Transcription initiation factor tfiid subunit 1: “Tfiid-based core pic on puma promoter”. Electron microscopy, 2 ligands (ZN, MG), 20 pockets (best druggability 0.89). MolNFT v1 #177365 on GenesisL1: 3D structure, binding sites and…

PDB
7EG8
Type
protein + DNA
Length
10,092 residues
Chains
39
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Transcription initiation factor tfiid subunit 1; Transcription initiation factor tfiid…
EC
2.3.1.48, 2.7.11.1, 3.6.4.12, 2.7.7.6
UniProt
P21675, Q6P1X5, O00268, Q15542, P49848, Q15545, Q7Z7C8, Q16594, Q12962, Q16514, P52657, P20226, P52655, Q00403, P35269, P13984, Q5VWG9, Q15544, Q15543, A0A4X1TVZ5, I3LCH3, A0A481BYI6, I3LSI7, A0A4X1VEK9, A0A4X1VKG7, A0A4X1ULF2, P60899, A0A4X1UK25, A0A4X1TRS6
Ligands
ZN, MG
Pockets
20 · best druggability 0.89

Structure

electron microscopy · 39 distinct chains · 35% helix, 17% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ATranscription initiation factor tfiid subunit 1 (EC 2.3.1.48, 2.7.11.1)protein60235% helix, 13% strandP21675
BTranscription initiation factor tfiid subunit 2protein96340% helix, 20% strandQ6P1X5
DTranscription initiation factor tfiid subunit 4protein16465% helix, 1% strandO00268
ETranscription initiation factor tfiid subunit 5protein54622% helix, 29% strandQ15542
FTranscription initiation factor tfiid subunit 6protein40457% helix, 2% strandP49848
GTranscription initiation factor tfiid subunit 7protein14525% helix, 38% strandQ15545
HTranscription initiation factor tfiid subunit 8protein20944% helix, 2% strandQ7Z7C8
ITranscription initiation factor tfiid subunit 9protein12055% helix, 0% strandQ16594
JTranscription initiation factor tfiid subunit 10protein8953% helix, 3% strandQ12962
LTranscription initiation factor tfiid subunit 12protein7664% helix, 3% strandQ16514
OTranscription initiation factor iia subunit 2protein9740% helix, 27% strandP52657
PTata-box-binding proteinprotein17728% helix, 34% strandP20226
QTranscription initiation factor iia subunit 1protein12243% helix, 32% strandP52655
RTranscription initiation factor iib (EC 2.3.1.48)protein25155% helix, 3% strandQ00403
SGeneral transcription factor iif subunit 1protein1089% helix, 49% strandP35269
TGeneral transcription factor iif subunit 2 (EC 3.6.4.12)protein22228% helix, 30% strandP13984
XDNA (85-mer)dna85——
YDNA (85-mer)dna85——
cTranscription initiation factor tfiid subunit 3protein12753% helix, 3% strandQ5VWG9
dTranscription initiation factor tfiid subunit 4protein15854% helix, 4% strandO00268
eTranscription initiation factor tfiid subunit 5protein53913% helix, 26% strandQ15542
fTranscription initiation factor tfiid subunit 6protein40355% helix, 4% strandP49848
iTranscription initiation factor tfiid subunit 9protein12145% helix, 3% strandQ16594
jTranscription initiation factor tfiid subunit 10protein9546% helix, 3% strandQ12962
kTranscription initiation factor tfiid subunit 11protein9863% helix, 0% strandQ15544
lTranscription initiation factor tfiid subunit 12protein10757% helix, 3% strandQ16514
mTranscription initiation factor tfiid subunit 13protein8739% helix, 1% strandQ15543
oRPB1protein142736% helix, 14% strand—
pDNA-directed RNA polymerase subunit beta (EC 2.7.7.6)protein113424% helix, 23% strandA0A4X1TVZ5
qDNA-directed RNA polymerase II subunit RPB3protein25716% helix, 26% strandI3LCH3
rDNA-directed RNA polymerase II subunit RPB4protein12852% helix, 2% strandA0A481BYI6
sDNA-directed RNA polymerase II subunit Eprotein20933% helix, 20% strandI3LSI7
tDNA-directed RNA polymerase II subunit Fprotein7935% helix, 19% strandA0A4X1VEK9
uDNA-directed RNA polymerase II subunit RPB7protein1718% helix, 29% strandA0A4X1VKG7
vDNA-directed RNA polymerases I, II, and III subunit RPABC3protein1480% helix, 47% strandA0A4X1ULF2
wDNA-directed RNA polymerase II subunit RPB9protein1147% helix, 27% strandP60899
xRPB10protein6439% helix, 5% strand—
yRNA_POL_L_2 domain-containing proteinprotein11738% helix, 19% strandA0A4X1UK25
zRPB12protein440% helix, 30% strandA0A4X1TRS6

Ligands and binding sites

  • ZN · Zinc ion · metal · 9 copies · chains R, o, p, q, w, x, z
  • MG · Magnesium ion · metal · chains o

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
111940.890.91134empty
211610.870.88131empty
39450.870.88111empty
411060.860.87106empty
510820.860.8793empty

Interfaces

113 interfaces between chains.

  • o–p · 8973 Ų buried · 91 hydrogen bonds · protein-protein
  • A–G · 5107 Ų buried · 79 hydrogen bonds · protein-protein
  • X–Y · 3919 Ų buried · 372 hydrogen bonds · nucleic-nucleic
  • O–Q · 2683 Ų buried · 39 hydrogen bonds · protein-protein
  • F–H · 2679 Ų buried · 26 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 1 disulfide (disulfide).

Compared structures

  • 7EG8 · TFIID-based core PIC on PUMA promoter · the same entry in another collection · chain O against O, TM-score 1.00

Analyse

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