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MolNFT v1 · #163854 · protein

Mn-containing form of the ribonucleotide reductase nrdb protein from leeuwenhoekiella blandensis

6SF5 · Ribonucleoside-diphosphate reductase, beta subunit 1: “Mn-containing form of the ribonucleotide reductase nrdb protein from leeuwenhoekiella blandensis”. X-ray diffraction, 1 ligand (MN), 7 pockets (best druggability 0.72). MolNFT…

PDB
6SF5
Type
protein
Length
592 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Ribonucleoside-diphosphate reductase, beta subunit 1
EC
1.17.4.1
UniProt
A3XHF9
Ligands
MN
Pockets
7 · best druggability 0.72

Structure

x-ray diffraction · 1 distinct chain · 75% helix, 1% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BRibonucleoside-diphosphate reductase, beta subunit 1 (EC 1.17.4.1)protein29675% helix, 1% strandA3XHF9

Ligands and binding sites

  • MN · Manganese (II) ion · metal · 4 copies · chains A, B

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

Pockets

7 pockets found on a 1 Å grid, 5 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12950.720.8662empty
26590.700.7752empty
36500.680.7752empty
4970.600.8720empty
5820.550.8517empty

Interfaces

1 interface between chains.

  • A–B · 1109 Ų buried · 11 hydrogen bonds · protein-protein

Compared structures

  • 6SF5 · Mn-containing form of the ribonucleotide reductase NrdB protein from Leeuwenhoekiella… · the same entry in another collection · chain A against A, TM-score 1.00

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