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MolNFT v1 · #181529 · protein

Crystal structure of human CYP3A4 bound to the testosterone dimer

7LXL: “Crystal structure of human CYP3A4 bound to the testosterone dimer”. X-ray diffraction, 2 ligands (HEM, YNV). MolNFT v1 #181529 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
7LXL
Type
protein
Length
453 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
P08684
Ligands
HEM, YNV

Structure

x-ray diffraction · 1 distinct chain.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein453—P08684

Ligands and binding sites

  • HEM · Protoporphyrin IX containing Fe · ligand · chains A
  • YNV · 17alpha-hydroxy-7alpha-[(2Z)-4-(17beta-hydroxy-3-oxo-8alpha-androst-4-en-7beta-yl)but-2-en-1-yl]-8alpha, 10alpha,13alpha,14beta-androst-4-en-3-one · ligand · chains A

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

Compared structures

  • 7LXL · Crystal structure of human CYP3A4 bound to the testosterone dimer · the same entry in another collection · chain A against A, TM-score 1.00
  • P08684 · AlphaFold monomer V2.0 prediction for cytochrome P450 3A4 (P08684) · a predicted model of the same protein · chain A against A, TM-score 0.97

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