8KBB

Structure of apo-CmTad1

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL02U1
Synchrotron site	SSRF
Beamline	BL02U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2023-06-17
Detector	DECTRIS EIGER2 X 9M
Wavelength(s)	0.979
Spacegroup name	P 21 21 21
Unit cell lengths	138.848, 144.516, 150.073
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	41.130 - 2.560
R-factor	0.2281
Rwork	0.227
R-free	0.26250
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.008
RMSD bond angle	1.090
Data reduction software	xia2
Data scaling software	Aimless
Phasing software	PHENIX
Refinement software	PHENIX ((1.18.2_3874: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	42.280	2.630
High resolution limit [Å]	2.560	2.560
Rmerge	0.241	2.489
Rmeas	0.251
Rpim	0.069	0.719
Total number of observations	1255851	91653
Number of reflections	97659	7159
<I/σ(I)>	10.1	1.1
Completeness [%]	100.0
Redundancy	12.9	12.8
CC(1/2)	0.994	0.620

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		291	2.0 M Ammonium sulfate, 1.4% v/v Polyethylene glycol 400