8J25

Crystal structure of PML B-box2 mutant

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL19U1
Synchrotron site	SSRF
Beamline	BL19U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-06-08
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.9791
Spacegroup name	H 3 2
Unit cell lengths	121.568, 121.568, 161.332
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	44.080 - 2.600
R-factor	0.2063
Rwork	0.204
R-free	0.24780
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.004
RMSD bond angle	0.630
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX ((1.21rc1_4924: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	44.080	2.690
High resolution limit [Å]	2.600	2.600
Rpim	0.092
Number of reflections	27057	2853
<I/σ(I)>	7.24
Completeness [%]	99.6
Redundancy	5
CC(1/2)	0.988	0.393

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.5	291	22% PEG 3350