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MolNFT v1 · #164671 · protein

Hydroxylamine oxidoreductase from brocadia fulgida

6T5E · Hydroxylamine oxidoreductase-like protein: “Hydroxylamine oxidoreductase from brocadia fulgida”. X-ray diffraction, 2 ligands (HEC, SO4), 4 pockets (best druggability 0.86). MolNFT v1 #164671 on GenesisL1: 3D structure, binding…

PDB
6T5E
Type
protein
Length
439 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Hydroxylamine oxidoreductase-like protein
UniProt
A0A0M2UZI7
Ligands
HEC, SO4
Pockets
4 · best druggability 0.86

Structure

x-ray diffraction · 1 distinct chain · 47% helix, 2% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AHydroxylamine oxidoreductase-like proteinprotein43947% helix, 2% strandA0A0M2UZI7

Ligands and binding sites

  • HEC · Heme C · ligand · 8 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

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
111360.860.87124HEC
2950.500.8217empty
3780.330.7417empty
4520.300.7518empty

Modifications

Observed in the structure: 16 cofactor (heme c attachment).

Compared structures

  • 6T5E · Hydroxylamine Oxidoreductase from Brocadia fulgida · the same entry in another collection · chain A against A, TM-score 1.00

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