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Structure paper

TitleDiscovery of a high affinity inhibitor of cGAS
Journal, issue, pagesto be published
Publish dateDec 20, 2018 (structure data deposition date)
AuthorsHall, J.
External linksSearch PubMed
MethodsX-ray diffraction
Resolution2.76 - 2.93 Å
Structure data

PDB-6nfg:
CYCLIC GMP-AMP SYNTHASE in complex with compound 16 inhibitor: 7-hydroxy-N-methyl-5-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide
Method: X-RAY DIFFRACTION / Resolution: 2.76 Å

PDB-6nfo:
CYCLIC GMP-AMP SYNTHASE in complex with compound 20 inhibitor: 7-hydroxy-N-[(2S)-1-hydroxypropan-2-yl]-5-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide
Method: X-RAY DIFFRACTION / Resolution: 2.93 Å

Chemicals

ChemComp-ZN:
Unknown entry

ChemComp-KKP:
7-hydroxy-N-methyl-5-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide

ChemComp-HOH:
WATER

ChemComp-KKM:
7-hydroxy-N-[(2S)-1-hydroxypropan-2-yl]-5-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide

Source
  • homo sapiens (human)
KeywordsTRANSFERASE/TRANSFERASE INHIBITOR / cGAS / STING / cGAMP / TRANSFERASE / TRANSFERASE-TRANSFERASE INHIBITOR complex

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