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MolNFT v1 · #149167 · protein

Influenza B/MEMPHIS/13/03 endonuclease with I38T mutation with bound inhibitor, baloxavir acid (bxa)

6FS9 · Polymerase acidic protein: “Influenza B/MEMPHIS/13/03 endonuclease with I38T mutation with bound inhibitor, baloxavir acid (bxa)”. X-ray diffraction, 3 ligands (E4Z, MN, CL), 1 pocket (best druggability 0.56). MolNFT v1 #149167 on…

PDB
6FS9
Type
protein
Length
183 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Polymerase acidic protein
EC
3.1.-.-
UniProt
Q5V8Z9
Ligands
E4Z, MN, CL
Pockets
1 · best druggability 0.56

Structure

x-ray diffraction · 1 distinct chain · 49% helix, 16% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APolymerase acidic protein (EC 3.1.-.-)protein18349% helix, 16% strandQ5V8Z9

Ligands and binding sites

  • E4Z · Baloxavir acid · ligand · chains A
  • MN · Manganese (II) ion · metal · 2 copies · chains A
  • CL · Chloride ion · ion · 2 copies · chains A

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

Pockets

1 pocket found on a 1 Å grid, 1 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12900.560.7634MN, E4Z, CL

Compared structures

  • 6FS9 · Influenza B/Memphis/13/03 endonuclease with I38T mutation with bound inhibitor, baloxavir… · the same entry in another collection · chain A against A, TM-score 1.00

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