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Influenza 2009 H1N1 endonuclease with 100 millimolar calcium

Analyse Influenza 2009 H1N1 endonuclease with 100 millimolar calcium in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4M5V
Type
protein
Length
200 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Polymerase pa
UniProt
F0TRT1
Ligands
CA, SO4
Pockets
2 · best druggability 0.60

Structure

x-ray diffraction · 1 distinct chain · 47% helix, 16% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APolymerase paprotein20047% helix, 16% strandF0TRT1

Ligands and binding sites

  • CA · Calcium ion · metal · 2 copies · chains A
  • SO4 · Sulfate ion · ion · 2 copies · chains A

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

Pockets

2 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13640.600.7638CA
2620.570.8919empty

Compared structures

  • 4M5V · Influenza 2009 H1N1 endonuclease with 100 millimolar calcium · the same entry in another collection · chain A against A, TM-score 1.00

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