9Y2G

Rubredoxin from Pyrococcus Furiosus at 293K, formyl-Methionine N-terminus

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRL BEAMLINE BL9-2
Synchrotron site	SSRL
Beamline	BL9-2
Temperature [K]	293
Detector technology	PIXEL
Collection date	2025-01-31
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.97946
Spacegroup name	P 21 21 21
Unit cell lengths	34.133, 34.687, 43.725
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	27.170 - 1.140
R-factor	0.13789
Rwork	0.137
R-free	0.15784
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.011
RMSD bond angle	1.845
Data reduction software	autoPROC
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	REFMAC (5.8.0430)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	27.170	1.263
High resolution limit [Å]	1.140	1.140
Rmerge	0.134	2.238
Rpim	0.042	0.750
Number of reflections	14424	721
<I/σ(I)>	9.1	1.6
Completeness [%]	91.3
Redundancy	11.3
CC(1/2)	0.993	0.502

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8	293	VAPOR DIFFUSION AGAINST 3.1 M NaCl with 3.6M Na,K PHOSPHATE, pH 8.0