9LYL

The X-ray diffraction structure of photosensitizer protein PSP2

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU FR-X
Temperature [K]	100
Detector technology	CCD
Collection date	2024-01-15
Detector	RIGAKU SATURN 944
Wavelength(s)	1.54187
Spacegroup name	P 41 21 2
Unit cell lengths	51.040, 51.040, 179.280
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	29.340 - 2.330
R-factor	0.2343
Rwork	0.232
R-free	0.27160
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5yr3
RMSD bond length	0.003
RMSD bond angle	0.596
Data reduction software	iMOSFLM
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX ((1.21.1_5286: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	29.340	2.410
High resolution limit [Å]	2.330	2.330
Number of reflections	9564	695
<I/σ(I)>	11.2
Completeness [%]	89.4
Redundancy	4.3
CC(1/2)	0.994	0.947

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	MICROBATCH		289.1	0.2M Magnesium Chloride 20% PEG3350