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MolNFT v1 · #190740 · protein

KRAS G12C in complex with compound 5C

7YCC: “KRAS G12C in complex with compound 5C”. X-ray diffraction, 3 ligands (GDP, IQC, MG). MolNFT v1 #190740 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
7YCC
Type
protein
Length
494 residues
Chains
3
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Ligands
GDP, IQC, MG

Structure

x-ray diffraction · 3 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein165——
B—protein166——
C—protein163——

Ligands and binding sites

  • GDP · Guanosine-5'-diphosphate · ligand · 3 copies · chains A, B, C
  • IQC · 1-[7-[6-chloranyl-8-fluoranyl-7-(5-methyl-1~{H}-indazol-4-yl)-2-[(1-methylpiperidin-4-yl) amino]quinazolin-4-yl]-2,7-diazaspiro[3.5]nonan-2-yl]propan-1-one · ligand · 3 copies · chains A, B, C
  • MG · Magnesium ion · metal · 3 copies · chains A, B, C

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

Compared structures

  • 7YCC · KRas G12C in complex with Compound 5c · the same entry in another collection · chain A against A, TM-score 1.00

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