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MolNFT v1 · #125895 · protein + RNA

Structure of bacterial 30S-IF1-IF3-mRNA translation pre-initiation complex (state-1C)

5LMP · 16S rRNA: “Structure of bacterial 30S-IF1-IF3-mRNA translation pre-initiation complex (state-1C)”. Electron microscopy, 2 ligands (MG, ZN), 20 pockets (best druggability 0.86). MolNFT v1 #125895 on GenesisL1: 3D structure, binding…

PDB
5LMP
Type
protein + RNA
Length
4,156 residues
Chains
24
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
MG, ZN
Pockets
20 · best druggability 0.86

Structure

electron microscopy · 24 distinct chains · 32% helix, 21% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A16S rRNArna1514——
B30S ribosomal protein S2protein23436% helix, 8% strandP80371
C30S ribosomal protein S3protein20635% helix, 25% strandP80372
D30S ribosomal protein S4protein20840% helix, 9% strandP80373
E30S ribosomal protein S5protein15030% helix, 39% strandQ5SHQ5
F30S ribosomal protein S6protein10129% helix, 42% strandQ5SLP8
G30S ribosomal protein S7protein15556% helix, 9% strandP17291
H30S ribosomal protein S8protein13828% helix, 32% strandQ5SHQ2
I30S ribosomal protein S9protein12725% helix, 22% strandP80374
J30S ribosomal protein S10protein987% helix, 36% strandQ5SHN7
K30S ribosomal protein S11protein11925% helix, 27% strandP80376
L30S ribosomal protein S12protein1249% helix, 25% strandQ5SHN3
M30S ribosomal protein S13protein11744% helix, 0% strandP80377
N30S ribosomal protein S14 type Zprotein6017% helix, 12% strandQ5SHQ1
O30S ribosomal protein S15protein8875% helix, 0% strandQ5SJ76
P30S ribosomal protein S16protein8323% helix, 25% strandQ5SJH3
Q30S ribosomal protein S17protein9913% helix, 52% strandQ5SHP7
R30S ribosomal protein S18protein7338% helix, 7% strandQ5SLQ0
S30S ribosomal protein S19protein804% helix, 16% strandQ5SHP2
T30S ribosomal protein S20protein9972% helix, 0% strandP80380
V30S ribosomal protein thxprotein2425% helix, 0% strandQ5SIH3
WTranslation initiation factor if-1protein718% helix, 45% strandQ5SHR1
XTranslation initiation factor if-3protein16834% helix, 32% strandQ5SKU2
YMRNArna20——

Ligands and binding sites

  • MG · Magnesium ion · metal · 108 copies · chains A, Q, E, K, O, L, W
  • 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
17990.860.9097MG
27860.860.9070empty
37710.860.9076MG
46130.850.9153empty
54870.840.9238empty

Interfaces

54 interfaces between chains.

  • A–L · 3743 Ų buried · 82 hydrogen bonds · protein-nucleic
  • A–D · 3469 Ų buried · 92 hydrogen bonds · protein-nucleic
  • A–I · 3233 Ų buried · 93 hydrogen bonds · protein-nucleic
  • A–Q · 2871 Ų buried · 59 hydrogen bonds · protein-nucleic
  • A–T · 2852 Ų buried · 66 hydrogen bonds · protein-nucleic

Compared structures

  • 5LMP · Structure of bacterial 30S-IF1-IF3-mRNA translation pre-initiation complex (state-1C) · the same entry in another collection · chain K against K, TM-score 1.00

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