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MolNFT v1 · #122106 · protein

Crystal structure of polymerase acid protein (pa) from influenza a virus, wilson-SMITH/1933 (H1N1) bound to follow on fragment ebsi-4720 1-(4-bromophenyl)-1H-imidazole

5IFC · Polymerase acidic protein: “Crystal structure of polymerase acid protein (pa) from influenza a virus, wilson-SMITH/1933 (H1N1) bound to…”. X-ray diffraction, 1 ligand (6AR), 7 pockets (best druggability 0.62). MolNFT v1 #122106 on…

PDB
5IFC
Type
protein
Length
410 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Polymerase acidic protein
UniProt
P15659
Ligands
6AR
Pockets
7 · best druggability 0.62

Structure

x-ray diffraction · 1 distinct chain · 44% helix, 19% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APolymerase acidic proteinprotein41044% helix, 19% strandP15659

Ligands and binding sites

  • 6AR · 1-(4-bromophenyl)-1H-imidazole · ligand · chains A
  • DMS · Dimethyl sulfoxide · additive · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12150.620.8229DMS
21230.470.7824empty
3540.400.81146AR
41190.390.7525empty
5650.350.7719empty

Compared structures

  • 5IFC · Crystal structure of polymerase acid protein (PA) from Influenza A virus… · the same entry in another collection · chain A against A, TM-score 1.00

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