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Structure paper

TitlePanDDA analysis -- Crystal Structure of PHIP in complex with Z198194396 synthetic derivative
Journal, issue, pagesTo Be Published
Publish dateDec 6, 2022 (structure data deposition date)
AuthorsGrosjean, H. / Aimon, A. / Hassell-Hart, S. / Bradshaw, W.J. / Krojer, T. / Talon, R. / Douangamath, A. / Koekemoer, L. / Biggin, P.C. / Spencer, J. / von Delft, F.
External linksSearch PubMed
MethodsX-ray diffraction
Resolution1.3 - 1.55 Å
Structure data

PDB-8bw2:
PanDDA analysis -- Crystal Structure of PHIP in complex with Z198194396 synthetic derivative
Method: X-RAY DIFFRACTION / Resolution: 1.35 Å

PDB-8bw3:
PanDDA analysis -- Crystal Structure of PHIP in complex with Z198194396 synthetic derivative
Method: X-RAY DIFFRACTION / Resolution: 1.3 Å

PDB-8bw4:
PanDDA analysis -- Crystal Structure of PHIP in complex with Z198194396 synthetic derivative
Method: X-RAY DIFFRACTION / Resolution: 1.55 Å

Chemicals

ChemComp-Y3Y:
(2R)-N-(2-methoxyethyl)-2-methyl-4-thiophen-2-ylcarbonyl-piperazine-1-carboxamide

ChemComp-HOH:
WATER

ChemComp-Y3V:
(2S)-N-(cyclopropylmethyl)-2-methyl-4-(1-methyl-1H-pyrrole-2-carbonyl)piperazine-1-carboxamide

ChemComp-Y3S:
(2R)-4-(3-fluoranylthiophen-2-yl)carbonyl-N-(4-methoxyphenyl)-2-methyl-piperazine-1-carboxamide

Source
  • homo sapiens (human)
KeywordsSIGNALING PROTEIN / brodomain / automated chemistry / reaction product

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