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MolNFT v1 · #186122 · protein

KRASG12C in complex with GDP and compound 3

7R0Q: “KRASG12C in complex with GDP and compound 3”. X-ray diffraction, 3 ligands (H0O, GDP, MG). MolNFT v1 #186122 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
7R0Q
Type
protein
Length
334 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
P01116
Ligands
H0O, GDP, MG

Structure

x-ray diffraction · 2 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein168—P01116
B—protein166—P01116

Ligands and binding sites

  • H0O · ~{N}-[4-[3,5-dimethyl-4-(5-methyl-2~{H}-indazol-4-yl) pyrazol-1-yl]phenyl]propanamide · ligand · 2 copies · chains A, B
  • GDP · Guanosine-5'-diphosphate · ligand · 2 copies · chains A, B
  • MG · Magnesium ion · metal · 3 copies · chains A, B

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

Compared structures

  • 7R0Q · KRasG12C in complex with GDP and compound 3 · the same entry in another collection · chain A against A, TM-score 1.00

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