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SARS-cov-2 NSP1 bound to the human 40S ribosomal subunit

Analyse SARS-cov-2 NSP1 bound to the human 40S ribosomal subunit in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6ZLW
Type
protein + RNA
Length
6,552 residues
Chains
36
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
40S ribosomal protein sa; 40S ribosomal protein S3A; 40S ribosomal protein S2; 40S…
EC
4.2.99.18, 3.4.19.12, 3.4.22.-, 3.4.22.69, 2.7.7.48, 3.6.4.12, 3.6.4.13, 3.1.13.-, 3.1.-.-, 2.1.1.-
UniProt
P08865, P61247, P15880, P62701, P23396, P62753, P62081, P62241, P46781, P46782, P62280, P46783, P62277, P25398, P62263, P62841, P62249, P08708, P62269, P39019, P60866, P62244, P62266, P62847, P63220, P62851, P42677, P62854, P62857, P62861, P62273, P62979, P62945, P63244, P0DTD1
Ligands
ZN
Pockets
20 · best druggability 0.88

Structure

electron microscopy · 36 distinct chains · 29% helix, 23% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
B40S ribosomal protein saprotein20638% helix, 15% strandP08865
C40S ribosomal protein S3Aprotein21329% helix, 33% strandP61247
D40S ribosomal protein S2protein21832% helix, 27% strandP15880
E40S ribosomal protein S4, X isoformprotein26214% helix, 32% strandP62701
F40S ribosomal protein S3 (EC 4.2.99.18)protein22537% helix, 27% strandP23396
G40S ribosomal protein S6protein23024% helix, 24% strandP62753
H40S ribosomal protein S7protein18633% helix, 23% strandP62081
I40S ribosomal protein S8protein20529% helix, 25% strandP62241
J40S ribosomal protein S9protein18047% helix, 4% strandP46781
K40S ribosomal protein S5protein18943% helix, 5% strandP46782
L40S ribosomal protein S11protein1515% helix, 30% strandP62280
M40S ribosomal protein S10protein9742% helix, 16% strandP46783
N40S ribosomal protein S13protein14954% helix, 0% strandP62277
O40S ribosomal protein S12protein12329% helix, 15% strandP25398
P40S ribosomal protein S14protein13521% helix, 25% strandP62263
Q40S ribosomal protein S15protein12035% helix, 16% strandP62841
R40S ribosomal protein S16protein13943% helix, 21% strandP62249
S40S ribosomal protein S17protein13241% helix, 5% strandP08708
T40S ribosomal protein S18protein14339% helix, 7% strandP62269
U40S ribosomal protein S19protein14444% helix, 13% strandP39019
V40S ribosomal protein S20protein10127% helix, 45% strandP60866
W40S ribosomal protein S15Aprotein12933% helix, 27% strandP62244
X40S ribosomal protein S23protein14125% helix, 29% strandP62266
Y40S ribosomal protein S24protein12432% helix, 29% strandP62847
Z40S ribosomal protein S21protein8220% helix, 27% strandP63220
a40S ribosomal protein S25protein7244% helix, 17% strandP62851
b40S ribosomal protein S27protein827% helix, 28% strandP42677
c40S ribosomal protein S26protein10112% helix, 23% strandP62854
d40S ribosomal protein S28protein610% helix, 39% strandP62857
e40S ribosomal protein S30protein5233% helix, 0% strandP62861
f40S ribosomal protein S29protein5431% helix, 11% strandP62273
gUbiquitin-40S ribosomal protein S27Aprotein726% helix, 17% strandP62979
h60S ribosomal protein L41protein2255% helix, 0% strandP62945
jReceptor of activated protein C kinase 1protein3140% helix, 52% strandP63244
218S ribosomal RNArna1665——
iNon-structural protein 1 (EC 3.4.19.12, 3.4.22.-, 3.4.22.69, 2.7.7.48, 3.6.4.12, 3.6.4.13, 3.1.13.-, 3.1.-.-, 2.1.1.-)protein3364% helix, 0% strandP0DTD1

Ligands and binding sites

  • ZN · Zinc ion · metal · 3 copies · chains c, f, g, 2

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
17670.880.9295empty
210610.880.9090empty
37810.880.9181empty
48410.870.9082empty
58700.870.9091empty

Interfaces

94 interfaces between chains.

  • G–2 · 5218 Ų buried · 120 hydrogen bonds · protein-nucleic
  • I–2 · 4314 Ų buried · 108 hydrogen bonds · protein-nucleic
  • E–2 · 3798 Ų buried · 72 hydrogen bonds · protein-nucleic
  • J–2 · 3705 Ų buried · 85 hydrogen bonds · protein-nucleic
  • X–2 · 3482 Ų buried · 68 hydrogen bonds · protein-nucleic

Compared structures

  • 6ZLW · SARS-CoV-2 Nsp1 bound to the human 40S ribosomal subunit · the same entry in another collection · chain L against L, TM-score 1.00

Analyse

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