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MolNFT v1 · #143419 · protein + RNA

Cryo-EM structure of the small subunit of leishmania ribosome bound to paromomycin

6AZ1 · Ribosomal protein S1E: “Cryo-EM structure of the small subunit of leishmania ribosome bound to paromomycin”. Electron microscopy, 2 ligands (PAR, MG), 20 pockets (best druggability 0.90). MolNFT v1 #143419 on GenesisL1: 3D…

PDB
6AZ1
Type
protein + RNA
Length
6,811 residues
Chains
38
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Ribosomal protein S1E; Ribosomal protein S2; Ribosomal protein S3; Ribosomal protein S4…
UniProt
E9BRS2, E9BQ25, E9BTJ0, E9BBI6, E9BNF0, E9B7A8, E9BAV6, E9BH78, E9BI96, E9BTG4, E9BMA8, E9BFB6, E9BBC0, E9BTF9, E9BJV7, E9BPR7, E9BJZ5, E9BR60, E9BU11, E9BHM6, E9BK95, E9BUA2, E9BIH3, E9BLG3, E9BTC5, Q9BIJ5
Ligands
PAR, MG
Pockets
20 · best druggability 0.90

Structure

electron microscopy · 37 distinct chains · 28% helix, 21% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ARibosomal protein S1Eprotein22526% helix, 29% strandE9BRS2
BRibosomal protein S2protein21132% helix, 14% strand—
CRibosomal protein S3protein21233% helix, 26% strandE9BQ25
DRibosomal protein S4protein18247% helix, 4% strandE9BTJ0
ERibosomal protein S4Eprotein26013% helix, 30% strandE9BBI6
FRibosomal protein S5protein22030% helix, 26% strandE9BNF0
GRibosomal protein S6Eprotein23827% helix, 21% strand—
HRibosomal protein S7protein18450% helix, 7% strand—
IRibosomal protein S7Eprotein20038% helix, 25% strandE9B7A8
JRibosomal protein S8protein12933% helix, 29% strandE9BAV6
KRibosomal protein S8Eprotein18323% helix, 27% strandE9BH78
LRibosomal protein S9protein14333% helix, 21% strandE9BI96
MRibosomal protein S10protein10219% helix, 42% strand—
NRibosomal protein S10Eprotein9141% helix, 22% strandE9BTG4
ORibosomal protein S11protein13724% helix, 25% strandE9BMA8
PRibosomal protein S12protein14218% helix, 28% strandE9BFB6
QRibosomal protein S12Eprotein11527% helix, 13% strandE9BBC0
RRibosomal protein S13protein14244% helix, 8% strandE9BTF9
SRibosomal protein S14protein5430% helix, 9% strandE9BJV7
TRibosomal protein S15protein14256% helix, 0% strandE9BPR7
URibosomal protein S17protein1560% helix, 27% strand—
VRibosomal protein S17Eprotein12255% helix, 1% strandE9BJZ5
WRibosomal protein S19protein11033% helix, 14% strand—
XRibosomal protein S19Eprotein15243% helix, 8% strandE9BR60
YRibosomal protein S21Eprotein8820% helix, 23% strand—
ZRibosomal protein S24Eprotein12731% helix, 23% strandE9BU11
aRibosomal protein S25Eprotein7242% helix, 21% strandE9BHM6
bRibosomal protein S26Eprotein10317% helix, 14% strandE9BK95
cRibosomal protein S27Eprotein847% helix, 24% strandE9BUA2
dRibosomal protein S28Eprotein650% helix, 46% strandE9BIH3
eRibosomal protein S30Eprotein5934% helix, 0% strandE9BLG3
fRibosomal protein S31Eprotein600% helix, 3% strandE9BTC5
gLACK1protein3000% helix, 45% strandQ9BIJ5
1Ribosomal RNA 18Srna1760——
2, 4TRNA-pherna76——
3P-site tRNArna77——
5MRNArna12——

Ligands and binding sites

  • PAR · Paromomycin · ligand · 6 copies · chains 1, L, P
  • MG · Magnesium ion · metal · 24 copies · chains C, D, 1, S, L, b, 5

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
110060.900.93122empty
28360.890.9389empty
311090.880.9090MG
47530.870.9184empty
55670.870.9371empty

Interfaces

107 interfaces between chains.

  • G–1 · 5526 Ų buried · 105 hydrogen bonds · protein-nucleic
  • E–1 · 4473 Ų buried · 88 hydrogen bonds · protein-nucleic
  • X–1 · 4105 Ų buried · 101 hydrogen bonds · protein-nucleic
  • D–1 · 3928 Ų buried · 80 hydrogen bonds · protein-nucleic
  • K–1 · 3837 Ų buried · 82 hydrogen bonds · protein-nucleic

Modifications

Observed in the structure: 37 modified, 13 disulfide, 1 covalent (nucleotide modification, disulfide, covalent ligand).

Compared structures

  • 6AZ1 · Cryo-EM structure of the small subunit of Leishmania ribosome bound to paromomycin · the same entry in another collection · chain B against B, TM-score 1.00

Analyse

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