Crystallography Open Database

Information card for entry 1572775

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Coordinates	1572775.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C45 H37 B Cl3 F2 N9 O2
Calculated formula	C45 H37 B Cl3 F2 N9 O2
Title of publication	Observing bioorthogonal macrocyclizations in the nuclear envelope of live cells using on/on fluorescence lifetime microscopy.
Authors of publication	Pim, Sebastian; Bourgès, Anaïs C; Wu, Dan; Durán-Sampedro, Gonzalo; Garre, Massimiliano; O'Shea, Donal F
Journal of publication	Chemical science
Year of publication	2024
Journal volume	15
Journal issue	36
Pages of publication	14913 - 14923
a	11.0839 ± 0.0013 Å
b	13.719 ± 0.002 Å
c	15.383 ± 0.003 Å
α	106.314 ± 0.005°
β	104.337 ± 0.004°
γ	105.219 ± 0.003°
Cell volume	2031.6 ± 0.6 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.056
Residual factor for significantly intense reflections	0.0433
Weighted residual factors for significantly intense reflections	0.1079
Weighted residual factors for all reflections included in the refinement	0.115
Goodness-of-fit parameter for all reflections included in the refinement	1.029
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
295042 (current)	2024-10-04	cif/ Adding structures of 1572775 via cif-deposit CGI script.	1572775.cif