6ZWJ

Neisseria gonorrhoeae transaldolase at 1.35 Angstrom resolution

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	2019-12-12
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.7293
Spacegroup name	P 21 21 21
Unit cell lengths	42.205, 82.955, 90.502
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	39.730 - 1.350
R-factor	0.148
Rwork	0.146
R-free	0.18250
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3clm
RMSD bond length	0.005
RMSD bond angle	0.864
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]	39.730	1.400
High resolution limit [Å]	1.350	1.350
Rmeas	0.080	1.210
Number of reflections	67040	6987
<I/σ(I)>	10.3	1.2
Completeness [%]	95.0	97.2
Redundancy	3.5	3.4
CC(1/2)	0.990	0.500

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293.15	PEG8000, Citrate, Sodium Phosphate, Sodium Chloride, Glycylglycine