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MolNFT v1 · #169533 · protein

Crystal structure of sting ref variant in complex with E7766

6XF4: “Crystal structure of sting ref variant in complex with E7766”. X-ray diffraction, 1 ligand (V5V). MolNFT v1 #169533 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6XF4
Type
protein
Length
351 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
Q86WV6
Ligands
V5V

Structure

x-ray diffraction · 2 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein174—Q86WV6
B—protein177—Q86WV6

Ligands and binding sites

  • V5V · (1R,3R,15E,28R,29R,30R,31R,34R,36R,39S,41R)-29,41-difluoro-34,39-disulfanyl-2,33,35,38,40,42-hexaoxa-4, 6,9,11,13,18,20,22,25,27-decaaza-34,39-diphosphaoctacyclo[28.6.4.1~3,36~.1~28,31~.0~4,8~.0~7, 12~.0~19,24~.0~23,27~]dotetraconta-5,7,9,11,15,19,21, 23,25-nonaene 34,39-dioxide (non-preferred name) · ligand · chains A, B
  • EDO · 1,2-ethanediol · additive · 6 copies · chains A, B

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

Compared structures

  • 6XF4 · Crystal structure of STING REF variant in complex with E7766 · the same entry in another collection · chain A against A, TM-score 1.00
  • Q86WV6 · AlphaFold monomer V2.0 prediction for stimulator of interferon genes protein (Q86WV6) · a predicted model of the same protein · chain A against A, TM-score 0.96

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