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Crystal structure of deah-box ATPase PRP43-S387A

Analyse Crystal structure of deah-box ATPase PRP43-S387A in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6QID
Type
protein
Length
703 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
PRP43
UniProt
G0RY84
Ligands
ADP, BEF, MG, CL, SO4
Pockets
7 · best druggability 0.72

Structure

x-ray diffraction · 1 distinct chain · 45% helix, 18% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APRP43protein70345% helix, 18% strandG0RY84

Ligands and binding sites

  • ADP · Adenosine-5'-diphosphate · ligand · chains A
  • BEF · Beryllium trifluoride ion · ligand · chains A
  • MG · Magnesium ion · metal · chains A
  • CL · Chloride ion · ion · 5 copies · chains A
  • SO4 · Sulfate ion · ion · 2 copies · chains A
  • MPD · (4S)-2-methyl-2,4-pentanediol · additive · 11 copies · chains A
  • PEG · Di(hydroxyethyl)ether · additive · 2 copies · 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, 4 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
110090.720.7680MPD, CL, SO4
23990.680.8039MPD
32250.640.8336MG, ADP, BEF
41650.620.8434empty
5720.350.7616MPD

Compared structures

  • 6QID · Crystal structure of DEAH-box ATPase Prp43-S387A · the same entry in another collection · chain A against A, TM-score 1.00

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