8RSZ

TRYPTOPHAN SYNTHASE measured via serial crystallography from a kapton HARE-chip (125 micron)

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]	293.15
Detector technology	PIXEL
Collection date	2023-06-27
Detector	DECTRIS EIGER X 4M
Wavelength(s)	0.976
Spacegroup name	C 1 2 1
Unit cell lengths	183.600, 61.500, 67.600
Unit cell angles	90.00, 94.55, 90.00

Refinement procedure

Resolution	91.510 - 2.200
R-factor	0.2025
Rwork	0.201
R-free	0.23240
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.008
RMSD bond angle	0.933
Data reduction software	CrystFEL (0.10.2)
Data scaling software	CrystFEL (0.10.2)
Phasing software	PHASER (2.8.3)
Refinement software	PHENIX ((1.17.1_3660: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	91.510	2.150
High resolution limit [Å]	2.070	2.070
Number of reflections	51011	5059
<I/σ(I)>	2.74	1.09
Completeness [%]	100.0	100
Redundancy	24
CC(1/2)	0.898	0.424

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	BATCH MODE	7.5	293	PEG 300, Tris-HCl, Cesium chloride