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MolNFT v1 · #168263 · protein

A crystal structure of EGFR(T790M/V948R) in complex with LN3754

6WAK: “A crystal structure of EGFR(T790M/V948R) in complex with LN3754”. X-ray diffraction, 3 ligands (ANP, TQA, MG). MolNFT v1 #168263 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6WAK
Type
protein
Length
1,209 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
P00533
Ligands
ANP, TQA, MG

Structure

x-ray diffraction · 4 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
D—protein297—P00533
A—protein297—P00533
B—protein316—P00533
C—protein299—P00533

Ligands and binding sites

  • ANP · Phosphoaminophosphonic acid-adenylate ester · ligand · 3 copies · chains D, A, B
  • TQA · N-(3-{5-[2-(acetylamino)pyridin-4-yl]-2-(methylsulfanyl)-1H-imidazol-4-yl}phenyl)-2-[(1-oxo-1, 3-dihydro-2H-isoindol-2-yl)methyl]benzamide · ligand · chains C
  • MG · Magnesium ion · metal · 3 copies · chains D, A, B

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

Compared structures

  • 6WAK · A crystal structure of EGFR(T790M/V948R) in complex with LN3754 · the same entry in another collection · chain C against C, TM-score 1.00
  • P00533 · AlphaFold monomer V2.0 prediction for epidermal growth factor receptor (P00533) · a predicted model of the same protein · chain C against A, TM-score 0.89

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