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MolNFT v1 · #109746 · protein

R2-like ligand-binding oxidase with aerobically reconstituted dimanganese cofactor

4XBW · Ribonucleotide reductase small subunit: “R2-like ligand-binding oxidase with aerobically reconstituted dimanganese cofactor”. X-ray diffraction, 2 ligands (PLM, MN), 2 pockets (best druggability 0.84). MolNFT v1 #109746 on…

PDB
4XBW
Type
protein
Length
274 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Ribonucleotide reductase small subunit
EC
1.17.4.1
UniProt
Q5KW80
Ligands
PLM, MN
Pockets
2 · best druggability 0.84

Structure

x-ray diffraction · 1 distinct chain · 81% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ARibonucleotide reductase small subunit (EC 1.17.4.1)protein27481% helix, 0% strandQ5KW80

Ligands and binding sites

  • PLM · Palmitic acid · ligand · chains A
  • MN · Manganese (II) ion · metal · 3 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, 1 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12260.840.9741PLM
2580.280.7419empty

Compared structures

  • 4XBW · R2-like ligand-binding oxidase with aerobically reconstituted dimanganese cofactor · the same entry in another collection · chain A against A, TM-score 1.00

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