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Structure of bacterial 30S-IF1-IF3-mRNA-tRNA translation pre- initiation COMPLEX(STATE-2B)

Analyse Structure of bacterial 30S-IF1-IF3-mRNA-tRNA translation pre- initiation… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5LMR
Type
protein + RNA
Length
4,237 residues
Chains
25
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
16S rRNA; 30S ribosomal protein S2; 30S ribosomal protein S3; 30S ribosomal protein S4…
UniProt
P80371, P80372, P80373, Q5SHQ5, Q5SLP8, P17291, Q5SHQ2, P80374, Q5SHN7, P80376, Q5SHN3, P80377, Q5SHQ1, Q5SJ76, Q5SJH3, Q5SHP7, Q5SLQ0, Q5SHP2, P80380, Q5SIH3, Q5SHR1, Q5SKU2
Ligands
ZN, MG
Pockets
20 · best druggability 0.86

Structure

electron microscopy · 25 distinct chains · 34% helix, 22% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A16S rRNArna1515——
B30S ribosomal protein S2protein23441% helix, 11% strandP80371
C30S ribosomal protein S3protein20633% helix, 24% strandP80372
D30S ribosomal protein S4protein20838% helix, 9% strandP80373
E30S ribosomal protein S5protein15030% helix, 36% strandQ5SHQ5
F30S ribosomal protein S6protein10130% helix, 49% strandQ5SLP8
G30S ribosomal protein S7protein15558% helix, 9% strandP17291
H30S ribosomal protein S8protein13829% helix, 31% strandQ5SHQ2
I30S ribosomal protein S9protein12730% helix, 24% strandP80374
J30S ribosomal protein S10protein9812% helix, 32% strandQ5SHN7
K30S ribosomal protein S11protein11924% helix, 29% strandP80376
L30S ribosomal protein S12protein1248% helix, 28% strandQ5SHN3
M30S ribosomal protein S13protein12147% helix, 0% strandP80377
N30S ribosomal protein S14 type Zprotein6022% helix, 10% strandQ5SHQ1
O30S ribosomal protein S15protein8876% helix, 0% strandQ5SJ76
P30S ribosomal protein S16protein8324% helix, 28% strandQ5SJH3
Q30S ribosomal protein S17protein9916% helix, 55% strandQ5SHP7
R30S ribosomal protein S18protein7334% helix, 8% strandQ5SLQ0
S30S ribosomal protein S19protein8212% helix, 16% strandQ5SHP2
T30S ribosomal protein S20protein9972% helix, 0% strandP80380
V30S ribosomal protein thxprotein2429% helix, 0% strandQ5SIH3
WTranslation initiation factor if-1protein717% helix, 48% strandQ5SHR1
XTranslation initiation factor if-3protein16836% helix, 32% strandQ5SKU2
YMRNArna17——
ZTrnairna77——

Ligands and binding sites

  • ZN · Zinc ion · metal · 2 copies · chains D, N
  • MG · Magnesium ion · metal · 2 copies · chains A, W, Z

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
18280.860.9071empty
211110.860.8878empty
310880.860.8893empty
45360.850.9250empty
55660.840.9061empty

Interfaces

58 interfaces between chains.

  • A–L · 3643 Ų buried · 98 hydrogen bonds · protein-nucleic
  • A–D · 3570 Ų buried · 102 hydrogen bonds · protein-nucleic
  • A–I · 3194 Ų buried · 100 hydrogen bonds · protein-nucleic
  • A–T · 2914 Ų buried · 71 hydrogen bonds · protein-nucleic
  • A–Q · 2774 Ų buried · 59 hydrogen bonds · protein-nucleic

Modifications

Observed in the structure: 5 modified (nucleotide modification).

Compared structures

  • 5LMR · Structure of bacterial 30S-IF1-IF3-mRNA-tRNA translation pre-initiation complex(state-2B) · the same entry in another collection · chain I against I, TM-score 1.00

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