5KGL

2.45A resolution structure of Apo independent phosphoglycerate mutase from C. elegans (orthorhombic form)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 17-ID
Synchrotron site	APS
Beamline	17-ID
Temperature [K]	100
Detector technology	PIXEL
Collection date	2014-04-19
Detector	DECTRIS PILATUS 6M
Wavelength(s)	1.00000
Spacegroup name	P 21 21 21
Unit cell lengths	70.321, 98.852, 173.144
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	40.437 - 2.450
R-factor	0.1883
Rwork	0.185
R-free	0.25950
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2ify
RMSD bond length	0.009
RMSD bond angle	0.936
Data reduction software	XDS
Data scaling software	Aimless (0.2.17)
Phasing software	PHASER (2.5.7)
Refinement software	PHENIX

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	98.850	98.850	2.540
High resolution limit [Å]	2.450	9.170	2.450
Rmerge	0.205	0.051	0.840
Rmeas	0.229
Rpim	0.099
Total number of observations	217179
Number of reflections	43707
<I/σ(I)>	7.6
Completeness [%]	97.5	90.8	99.4
Redundancy	5	5.2	4.7
CC(1/2)	0.976

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6.5	293	25% (w/v) PEG 3350, 0.1 M Bis-Tris, 0.2 M ammonium sulfate