5Y64

Phosphoglycerate mutase 1 H11 phosphorylated form complexed with KH1

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL18U1
Synchrotron site	SSRF
Beamline	BL18U1
Temperature [K]	100
Detector technology	CCD
Collection date	2015-10-03
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.97930
Spacegroup name	P 21 21 21
Unit cell lengths	82.527, 82.736, 104.361
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	38.373 - 2.149
R-factor	0.205
Rwork	0.203
R-free	0.23620
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.009
RMSD bond angle	1.163
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX (phenix.refine: 1.8.2_1309)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	2.230
High resolution limit [Å]	2.149	4.630	2.150
Rmerge	0.065	0.032	0.744
Rmeas	0.071	0.035	0.801
Rpim	0.026	0.013	0.295
Number of reflections	39535	4169	3889
<I/σ(I)>	11.3
Completeness [%]	99.9	99.5	100
Redundancy	7.1	6.9	7.3
CC(1/2)		0.999	0.825

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6	289	MES, PEG3350