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Structure of yeast transcription pre-initiation complex with tfiih

Analyse Structure of yeast transcription pre-initiation complex with tfiih in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5OQJ
Type
protein + DNA
Length
8,336 residues
Chains
31
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
DNA-directed RNA polymerase II subunit RPB1; DNA-directed RNA polymerase II subunit RPB2…
EC
2.7.7.6, 3.6.4.12
UniProt
P04050, P08518, P16370, P20433, P20434, P20435, P34087, P20436, P27999, P22139, P38902, P40422, P29055, P13393, P41895, P41896, P32773, P32774, P36100, P36145, P06839, P32776, Q02939, Q03290, Q12004, Q3E7C1, Q04673, Q00578
Ligands
SF4, ZN, MG
Pockets
20 · best druggability 0.84

Structure

electron microscopy · 31 distinct chains · 40% helix, 19% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ADNA-directed RNA polymerase II subunit RPB1 (EC 2.7.7.6)protein139841% helix, 16% strandP04050
BDNA-directed RNA polymerase II subunit RPB2 (EC 2.7.7.6)protein115229% helix, 25% strandP08518
CDNA-directed RNA polymerase II subunit RPB3protein26225% helix, 27% strandP16370
DDNA-directed RNA polymerase II subunit RPB4protein15754% helix, 5% strandP20433
EDNA-directed RNA polymerases I, II, and III subunit RPABC1protein21341% helix, 22% strandP20434
FDNA-directed RNA polymerases I, II, and III subunit RPABC2protein8335% helix, 16% strandP20435
GDNA-directed RNA polymerase II subunit RPB7protein17113% helix, 50% strandP34087
HDNA-directed RNA polymerases I, II, and III subunit RPABC3protein1360% helix, 49% strandP20436
IDNA-directed RNA polymerase II subunit RPB9protein1164% helix, 27% strandP27999
JDNA-directed RNA polymerases I, II, and III subunit RPABC5protein6554% helix, 2% strandP22139
KDNA-directed RNA polymerase II subunit RPB11protein11239% helix, 25% strandP38902
LDNA-directed RNA polymerases I, II, and III subunit RPABC4protein450% helix, 20% strandP40422
MTranscription initiation factor iibprotein27957% helix, 5% strandP29055
NNontemplate DNAdna76——
OTata-box-binding proteinprotein18027% helix, 37% strandP13393
QTranscription initiation factor iif subunit alphaprotein14818% helix, 33% strandP41895
RTranscription initiation factor iif subunit beta (EC 3.6.4.12)protein19030% helix, 31% strandP41896
TTemplate DNAdna72——
UTranscription initiation factor iia large subunitprotein9243% helix, 42% strandP32773
VTranscription initiation factor iia subunit 2protein10038% helix, 40% strandP32774
WTranscription initiation factor iie subunit alphaprotein25857% helix, 10% strandP36100
XTranscription initiation factor iie subunit betaprotein16043% helix, 5% strandP36145
0DNA repair helicase RAD3 (EC 3.6.4.12)protein69849% helix, 10% strandP06839
1RNA polymerase II transcription factor B subunit 1protein49160% helix, 10% strandP32776
2RNA polymerase II transcription factor B subunit 2protein39558% helix, 12% strandQ02939
3RNA polymerase II transcription factor B subunit 3protein13848% helix, 6% strandQ03290
4RNA polymerase II transcription factor B subunit 4protein29742% helix, 16% strandQ12004
5RNA polymerase II transcription factor B subunit 5protein6650% helix, 26% strandQ3E7C1
6Suppressor of stem-loop protein 1protein33533% helix, 21% strandQ04673
7DNA repair helicase RAD25 (EC 3.6.4.12)protein40846% helix, 18% strandQ00578
ZUnknown proteinprotein4323% helix, 44% strand—

Ligands and binding sites

  • SF4 · Iron/sulfur cluster · ligand · chains 0
  • ZN · Zinc ion · metal · 16 copies · chains A, B, C, I, J, L, M, W, 3, 4, 6
  • 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
19530.840.86102empty
25810.840.8973empty
310940.840.85124empty
411690.840.8596empty
59200.840.85107empty

Interfaces

78 interfaces between chains.

  • A–B · 9929 Ų buried · 121 hydrogen bonds · protein-protein
  • N–T · 3242 Ų buried · 225 hydrogen bonds · nucleic-nucleic
  • A–M · 2730 Ų buried · 30 hydrogen bonds · protein-protein
  • U–V · 2600 Ų buried · 22 hydrogen bonds · protein-protein
  • Q–R · 2122 Ų buried · 38 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 1 covalent (covalent ligand).

Compared structures

  • 5OQJ · Structure of yeast transcription pre-initiation complex with tfiih · the same entry in another collection · chain K against K, TM-score 1.00

Analyse

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