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MolNFT v1 · #64073 · protein

Crystal structure of RPE65 at 2.14 ångström resolution

3FSN · Retinal pigment epithelium-specific 65 kda protein: “Crystal structure of RPE65 at 2.14 ångström resolution”. X-ray diffraction, 1 ligand (FE2), 8 pockets (best druggability 0.84). MolNFT v1 #64073 on GenesisL1: 3D structure…

PDB
3FSN
Type
protein
Length
1,027 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Retinal pigment epithelium-specific 65 kda protein
EC
5.2.1.7
UniProt
Q28175
Ligands
FE2
Pockets
8 · best druggability 0.84

Structure

x-ray diffraction · 2 distinct chains · 11% helix, 44% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ARetinal pigment epithelium-specific 65 kda protein (EC 5.2.1.7)protein51311% helix, 44% strandQ28175
BRetinal pigment epithelium-specific 65 kda protein (EC 5.2.1.7)protein51411% helix, 44% strandQ28175

Ligands and binding sites

  • FE2 · Fe (II) ion · metal · 2 copies · chains A, B
  • PG4 · Tetraethylene glycol · additive · 2 copies · chains A, B

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

Pockets

8 pockets found on a 1 Å grid, 6 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15880.840.8866empty
26300.830.8779empty
34740.790.8752empty
45940.780.8453empty
53470.560.7555empty

Interfaces

1 interface between chains.

  • A–B · 1624 Ų buried · 29 hydrogen bonds · protein-protein

Compared structures

  • 3FSN · Crystal structure of RPE65 at 2.14 angstrom resolution · the same entry in another collection · chain A against A, TM-score 1.00
  • Q28175 · AlphaFold monomer V2.0 prediction for retinoid isomerohydrolase (Q28175) · a predicted model of the same protein · chain B against A, TM-score 1.00

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