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MolNFT v1 · #129606 · protein

The crystal structure of P450 CYP121 in complex with lead compound 7B

5OPA: “The crystal structure of P450 CYP121 in complex with lead compound 7B”. X-ray diffraction, 3 ligands (HEM, A2W, SO4). MolNFT v1 #129606 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
5OPA
Type
protein
Length
393 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
P9WPP6
Ligands
HEM, A2W, SO4

Structure

x-ray diffraction · 1 distinct chain.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein393—P9WPP6

Ligands and binding sites

  • HEM · Protoporphyrin IX containing Fe · ligand · chains A
  • A2W · 3-(4-fluorophenyl)-4-(imidazol-1-ylmethyl)-1-phenyl-pyrazole · ligand · chains A
  • SO4 · Sulfate ion · ion · 5 copies · chains A
  • PEG · Di(hydroxyethyl)ether · additive · chains A

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

Compared structures

  • 5OPA · The crystal structure of P450 CYP121 in complex with lead compound 7b · the same entry in another collection · chain A against A, TM-score 1.00
  • P9WPP6 · AlphaFold monomer V2.0 prediction for mycocyclosin synthase (P9WPP6) · a predicted model of the same protein · chain A against A, TM-score 0.99

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