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MolNFT v1 · #151922 · protein

Flavin analogue sheds light on light-oxygen-voltage domain mechanism

6I21 · AUREOCHROME1-like protein: “Flavin analogue sheds light on light-oxygen-voltage domain mechanism”. X-ray diffraction, 3 ligands (FMN, MG, CL), 1 pocket (best druggability 0.70). MolNFT v1 #151922 on GenesisL1: 3D structure, binding…

PDB
6I21
Type
protein
Length
135 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
AUREOCHROME1-like protein
UniProt
C5NSW6
Ligands
FMN, MG, CL
Pockets
1 · best druggability 0.70

Structure

x-ray diffraction · 1 distinct chain · 39% helix, 30% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AAUREOCHROME1-like proteinprotein13539% helix, 30% strandC5NSW6

Ligands and binding sites

  • FMN · Flavin mononucleotide · ligand · 2 copies · chains A
  • MG · Magnesium ion · metal · 2 copies · chains A
  • CL · Chloride ion · ion · chains A
  • EDO · 1,2-ethanediol · additive · 6 copies · chains A
  • PEG · Di(hydroxyethyl)ether · additive · 3 copies · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11990.700.8729CL, FMN

Compared structures

  • 6I21 · Flavin Analogue Sheds Light on Light-Oxygen-Voltage Domain Mechanism · the same entry in another collection · chain A against A, TM-score 1.00

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