Crystallography Open Database

Information card for entry 1506796

Preview

Coordinates	1506796.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C21 H17 F12 N5 O2 P2
Calculated formula	C21 H17 F12 N5 O2 P2
Title of publication	DNA binding of an organic dppz-based intercalator.
Authors of publication	Phillips, Tim; Haq, Ihtshamul; Meijer, Anthony J. H. M.; Adams, Harry; Soutar, Ian; Swanson, Linda; Sykes, Matthew J.; Thomas, Jim A.
Journal of publication	Biochemistry
Year of publication	2004
Journal volume	43
Journal issue	43
Pages of publication	13657 - 13665
a	13.4948 ± 0.0019 Å
b	13.8511 ± 0.0019 Å
c	23.133 ± 0.003 Å
α	93.354 ± 0.003°
β	100.455 ± 0.003°
γ	119.018 ± 0.002°
Cell volume	3664 ± 0.9 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1555
Residual factor for significantly intense reflections	0.0919
Weighted residual factors for significantly intense reflections	0.2502
Weighted residual factors for all reflections included in the refinement	0.2958
Goodness-of-fit parameter for all reflections included in the refinement	1.065
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
176729 (current)	2016-02-18	cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 1.	1506796.cif
120071	2014-07-11	Adding DOIs to range 1 structures.	1506796.cif
51361	2012-04-07	../uploads/cif-deposit/cod/cif Adding structures of 1506796 via cif-deposit CGI script.	1506796.cif