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Structure of the ribosomal decoding complex at ambient temperature

Analyse Structure of the ribosomal decoding complex at ambient temperature in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6CAO
Type
protein + RNA
Length
3,916 residues
Chains
23
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
16S ribosomal RNA rRNA; 30S ribosomal protein S2; 30S ribosomal protein S3; 30S ribosomal…
UniProt
P80371, P80372, P80373, Q5SHQ5, Q5SLP8, P17291, P0DOY9, P80374, Q5SHN7, P80376, Q5SHN3, P62655, P0DOY6, Q5SJ76, Q5SJH3, P0DOY7, Q5SLQ0, Q5SHP2, P80380, Q5SIH3
Ligands
PAR, MG, K, ZN
Pockets
20 · best druggability 0.88

Structure

x-ray diffraction · 23 distinct chains · 36% helix, 21% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A16S ribosomal RNA rRNArna1512——
B30S ribosomal protein S2protein23544% helix, 14% strandP80371
C30S ribosomal protein S3protein20641% helix, 23% strandP80372
D30S ribosomal protein S4protein20838% helix, 8% strandP80373
E30S ribosomal protein S5protein15029% helix, 41% strandQ5SHQ5
F30S ribosomal protein S6protein10129% helix, 49% strandQ5SLP8
G30S ribosomal protein S7protein15554% helix, 10% strandP17291
H30S ribosomal protein S8protein13827% helix, 33% strandP0DOY9
I30S ribosomal protein S9protein12734% helix, 24% strandP80374
J30S ribosomal protein S10protein9821% helix, 28% strandQ5SHN7
K30S ribosomal protein S11protein11727% helix, 29% strandP80376
L30S ribosomal protein S12protein1248% helix, 29% strandQ5SHN3
M30S ribosomal protein S13protein11847% helix, 2% strandP62655
N30S ribosomal protein S14 type Zprotein6023% helix, 8% strandP0DOY6
O30S ribosomal protein S15protein8875% helix, 0% strandQ5SJ76
P30S ribosomal protein S16protein8323% helix, 30% strandQ5SJH3
Q30S ribosomal protein S17protein9916% helix, 52% strandP0DOY7
R30S ribosomal protein S18protein7337% helix, 8% strandQ5SLQ0
S30S ribosomal protein S19protein8029% helix, 19% strandQ5SHP2
T30S ribosomal protein S20protein9973% helix, 0% strandP80380
U30S ribosomal protein thxprotein2429% helix, 8% strandQ5SIH3
WRNA (5'-R(*GP*GP*GP*AP*UP*UP*GP*AP*AP*AP*AP*UP*CP*CP*C)- 3')rna15——
YRNA (5'-R(*UP*UP*UP*UP*UP*U)-3')rna6——

Ligands and binding sites

  • PAR · Paromomycin · ligand · 6 copies · chains A, E, O, D
  • MG · Magnesium ion · metal · 303 copies · chains A, D, E, O, Q, K, W, N, I, U, T, J, M, L, C, F, G, P, S, Y
  • K · Potassium ion · metal · 37 copies · chains A, D, C, E
  • ZN · Zinc ion · metal · 2 copies · chains D, N

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
111760.880.9085MG
27480.840.8890MG
38630.840.8759MG
46220.830.8963K, MG
57330.830.8881K, MG

Interfaces

46 interfaces between chains.

  • A–L · 3497 Ų buried · 84 hydrogen bonds · protein-nucleic
  • A–D · 3157 Ų buried · 98 hydrogen bonds · protein-nucleic
  • A–I · 2998 Ų buried · 81 hydrogen bonds · protein-nucleic
  • A–T · 2707 Ų buried · 64 hydrogen bonds · protein-nucleic
  • A–Q · 2677 Ų buried · 54 hydrogen bonds · protein-nucleic

Modifications

Observed in the structure: 15 modified, 1 covalent (nucleotide modification, covalent ligand, nonstandard).

Compared structures

  • 6CAO · Structure of the ribosomal decoding complex at ambient temperature · the same entry in another collection · chain Y against Y, TM-score 1.00

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