6ZWF

Neisseria gonorrhoeae transaldolase

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]	80
Detector technology	PIXEL
Collection date	2020-03-12
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.7293
Spacegroup name	P 21 21 21
Unit cell lengths	42.087, 82.910, 89.465
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	41.455 - 1.050
R-factor	0.1337
Rwork	0.133
R-free	0.15320
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3clm
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHENIX
Refinement software	PHENIX (1.13_2998)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	41.455	1.100
High resolution limit [Å]	1.050	1.050
Rmeas	0.074	1.980
Number of reflections	145716	18762
<I/σ(I)>	10.91	1.04
Completeness [%]	99.6	99.8
Redundancy	4.5	4.5
CC(1/2)	0.999	0.506

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293.15	PEG8000, Citrate, Sodium phosphate, Sodium chloride, Glycylglycin