6QNC

Liquid Application Method for time-resolved Analyses (LAMA) by serial synchrotron crystallography, Xylose Isomerase 0.1 s timepoint

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PETRA III, EMBL c/o DESY BEAMLINE P14 (MX2)
Synchrotron site	PETRA III, EMBL c/o DESY
Beamline	P14 (MX2)
Temperature [K]	293
Detector technology	PIXEL
Collection date	2018-10-30
Detector	DECTRIS EIGER R 4M
Wavelength(s)	0.9778
Spacegroup name	I 2 2 2
Unit cell lengths	94.630, 99.110, 87.320
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	19.977 - 1.897
R-factor	0.1641
Rwork	0.163
R-free	0.19020
RMSD bond length	0.010
RMSD bond angle	0.973
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX ((1.13_2998: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	19.977	1.970
High resolution limit [Å]	1.897	1.900
Number of reflections	32696
<I/σ(I)>	6.3
Completeness [%]	99.5
Redundancy	168.9

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	BATCH MODE		293	35% (w/v) PEG3350, 200 mM lithium sulfate and 10 mM Hepes/NaOH pH 7.5