9ULA

Cryogenic temperature crystal structure of Nmar_1308 protein at 2.96 angstrom resolution

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SPRING-8 BEAMLINE BL32XU
Synchrotron site	SPring-8
Beamline	BL32XU
Temperature [K]	100
Detector technology	PIXEL
Collection date	2023-11-17
Detector	DECTRIS EIGER X 9M
Wavelength(s)	1
Spacegroup name	C 1 2 1
Unit cell lengths	356.960, 130.530, 82.640
Unit cell angles	90.00, 100.17, 90.00

Refinement procedure

Resolution	43.920 - 2.960
R-factor	0.4425
Rwork	0.442
R-free	0.46080
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.004
RMSD bond angle	0.695
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHENIX
Refinement software	PHENIX ((1.19.2_4158: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	43.920	3.030
High resolution limit [Å]	2.960	2.960
Number of reflections	77784	12533
<I/σ(I)>	8.85
Completeness [%]	99.9
Redundancy	11.83
CC(1/2)	0.980	0.580

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	BATCH MODE		298	0.1M Sodium chloride, 0.002M Spermine tetrahydrochloride, 0.05M Bis-Tris pH 7.0, 37% w/v PEG 1000