9RXG

Work experience structure of Bovine Hemoglobin, collected at room temperature.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE VMXi
Synchrotron site	Diamond
Beamline	VMXi
Temperature [K]	293
Detector technology	PIXEL
Collection date	2025-07-03
Detector	DECTRIS EIGER2 X 4M
Wavelength(s)	0.7749
Spacegroup name	P 21 21 21
Unit cell lengths	64.774, 79.118, 109.856
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	64.200 - 2.620
R-factor	0.1941
Rwork	0.190
R-free	0.23300
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.004
RMSD bond angle	0.705
Data reduction software	DIALS
Data scaling software	DIALS
Phasing software	PHASER
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	64.770	2.700
High resolution limit [Å]	2.620	2.620
Number of reflections	17609	1421
<I/σ(I)>	6.7
Completeness [%]	100.0	99.1
Redundancy	73
CC(1/2)	1.000	0.500

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6.7	293	0.1M Bis Tris Propane pH 6.7 28% PEG 3350 0.2M NaCl 0.2M KCl