8T8T

Crystal structure of TET25 in complex with PyDH2 ligand in P212121 space group

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 24-ID-C
Synchrotron site	APS
Beamline	24-ID-C
Temperature [K]	183
Detector technology	PIXEL
Collection date	2023-02-24
Detector	DECTRIS PILATUS 6M-F
Wavelength(s)	0.9791
Spacegroup name	P 21 21 21
Unit cell lengths	29.624, 51.923, 88.064
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	25.960 - 1.620
R-factor	0.2081
Rwork	0.207
R-free	0.22790
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.012
RMSD bond angle	1.311
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHENIX (1.19.2_4158)
Refinement software	PHENIX (1.21.1_5286)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	25.960	1.650
High resolution limit [Å]	1.620	1.620
Rmerge	0.103
Number of reflections	8871	343
<I/σ(I)>	8.8	0.8
Completeness [%]	98.4	73.3
Redundancy	12.8	12.6
CC(1/2)	0.999	0.530

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.5	295	0.05 M KCl, 0.1 M LiCl, 0.012 M spermine tetrahydrochloride, 0.05 M MES pH 6.5, 25% v/v PEG 400