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SARS-cov-2 NSP15 endoribonuclease pre-cleavage state

Analyse SARS-cov-2 NSP15 endoribonuclease pre-cleavage state in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7N33
Type
protein
Length
2,076 residues
Chains
6
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Uridylate-specific endoribonuclease
EC
3.1.-.-
UniProt
P0DTD1
Ligands
UFT
Pockets
20 · best druggability 0.85

Structure

electron microscopy · 1 distinct chain · 21% helix, 32% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, C, D, E, FUridylate-specific endoribonuclease (EC 3.1.-.-)protein34621% helix, 32% strandP0DTD1

Ligands and binding sites

  • UFT · 2'-deoxy-2'-fluorouridine 5'-(dihydrogen phosphate) · ligand · 6 copies · chains A, B, C, D, E, F

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Pockets

20 pockets found on a 1 Å grid, 10 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16270.850.90129empty
23590.780.8948empty
32350.750.8945empty
43740.710.8351empty
54440.690.8051empty

Interfaces

15 interfaces between chains.

  • D–E · 1159 Ų buried · 9 hydrogen bonds · protein-protein
  • E–F · 1158 Ų buried · 9 hydrogen bonds · protein-protein
  • D–F · 1156 Ų buried · 9 hydrogen bonds · protein-protein
  • B–C · 1139 Ų buried · 8 hydrogen bonds · protein-protein
  • A–C · 1136 Ų buried · 8 hydrogen bonds · protein-protein

Compared structures

  • 7N33 · SARS-CoV-2 Nsp15 endoribonuclease pre-cleavage state · the same entry in another collection · chain B against B, TM-score 1.00

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