MolNFT v1 · #182848 · protein

Co-complex CYP46A1 with compound 3F

7N6F: “Co-complex CYP46A1 with compound 3F”. X-ray diffraction, 2 ligands (HEM, 0I1). MolNFT v1 #182848 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB: 7N6F
Type: protein
Length: 436 residues
Chains: 1
Method: x-ray diffraction
Collection: MolNFT v1 / PDB
Contract: 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner: 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt: Q9Y6A2
Ligands: HEM, 0I1

Structure

x-ray diffraction · 1 distinct chain.

Chain	Molecule	Type	Residues	Secondary structure	UniProt
A	—	protein	436	—	Q9Y6A2

Ligands and binding sites

HEM · Protoporphyrin IX containing Fe · ligand · chains A
0I1 · (3-fluoroazetidin-1-yl){1-[4-(4-fluorophenyl)pyrimidin-5-yl]piperidin-4-yl}methanone · ligand · chains A
EDO · 1,2-ethanediol · additive · 4 copies · chains A
GOL · Glycerol · additive · 4 copies · chains A

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

Compared structures

7N6F · Co-complex CYP46A1 with compound 3f · the same entry in another collection · chain A against A, TM-score 1.00
Q9Y6A2 · AlphaFold monomer V2.0 prediction for cholesterol 24-hydroxylase (Q9Y6A2) · a predicted model of the same protein · chain A against A, TM-score 0.99

Analyse

Open in the research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides and crosslinks on the 3D structure
Every structure of UniProt Q9Y6A2
Elsewhere: RCSB PDB 7N6F · PDBe 7N6F · UniProt Q9Y6A2

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