6ZMY

Crystal structure of hemoglobin from turkey (Meleagiris gallopova) crystallized in monoclinic form at 1.66 Angstrom resolution

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE MASSIF-1
Synchrotron site	ESRF
Beamline	MASSIF-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2016-07-21
Detector	DECTRIS PILATUS3 2M
Wavelength(s)	0.966
Spacegroup name	P 1 21 1
Unit cell lengths	58.580, 80.520, 64.420
Unit cell angles	90.00, 96.30, 90.00

Refinement procedure

Resolution	64.031 - 1.655
R-factor	0.2025
Rwork	0.200
R-free	0.25000
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1faw
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.15.2_3472)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	64.031	1.684
High resolution limit [Å]	1.655	1.655
Rmerge	0.065
Rmeas	0.080
Number of reflections	70052	3465
<I/σ(I)>	8.6	2.1
Completeness [%]	98.9	98.6
Redundancy	2.9	2.8
CC(1/2)	0.997	0.484

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.2	293	50% of PEG3350 in 50mM phosphate buffer at pH7.2