7O5Z

Human phosphomannomutase 2 (PMM2) with mutation T237M in apo state

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALBA BEAMLINE XALOC
Synchrotron site	ALBA
Beamline	XALOC
Temperature [K]	100
Detector technology	PIXEL
Collection date	2020-07-09
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.97926
Spacegroup name	P 65 2 2
Unit cell lengths	70.934, 70.934, 363.616
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	61.430 - 2.070
R-factor	0.2047
Rwork	0.204
R-free	0.22390
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	7o0c
RMSD bond length	0.004
RMSD bond angle	0.686
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.19.2_4158)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	61.430	2.130
High resolution limit [Å]	2.070	2.070
Rmerge	0.134	1.600
Rpim	0.034	0.422
Number of reflections	34061	2617
<I/σ(I)>	15.4	1.8
Completeness [%]	98.3	100
Redundancy	16.5	15.5
CC(1/2)	0.999	0.610

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.5	293	Drops made by mixing 1 microliter of protein solution and 1 microliter of crystallization deposit solution. Protein solution contained 5 mg/ml protein in 20 mM Hepes pH 7.5 and 0.2 M NaCl. Crystallization solution contained 0.3-0.4 M MgCl2, 24% PEG3350 and 0.1 M HEPES pH 7.5