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MolNFT v1 · #173313 · protein

Crystal structure of SOS1 in complex with compound 6

7AVS: “Crystal structure of SOS1 in complex with compound 6”. X-ray diffraction, 1 ligand (S3Q). MolNFT v1 #173313 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
7AVS
Type
protein
Length
928 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
Q07889
Ligands
S3Q

Structure

x-ray diffraction · 2 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein466—Q07889
B—protein462—Q07889

Ligands and binding sites

  • S3Q · 6,7-dimethoxy-2-methyl-~{N}-[(1~{R})-1-[3-(trifluoromethyl)phenyl]ethyl]quinazolin-4-amine · ligand · 2 copies · chains A, B
  • IMD · Imidazole · additive · 4 copies · chains A, B

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

Compared structures

  • 7AVS · Crystal structure of SOS1 in complex with compound 6 · the same entry in another collection · chain A against A, TM-score 1.00

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