7B0L

Neisseria gonorrhoeae transaldolase, low-dose inhouse

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SEALED TUBE
Source details	RIGAKU MICROMAX-003
Temperature [K]	100
Detector technology	PIXEL
Collection date	2020-11-09
Detector	DECTRIS PILATUS 200K
Wavelength(s)	1.54187
Spacegroup name	P 21 21 21
Unit cell lengths	42.150, 82.910, 89.530
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	38.140 - 1.650
R-factor	0.1528
Rwork	0.151
R-free	0.19090
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3clm
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHENIX
Refinement software	PHENIX (1.17.1_3660)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	44.770	44.770	1.700
High resolution limit [Å]	1.650	20.000	1.650
Rmerge	0.086	0.038	0.647
Rmeas	0.092	0.040	0.815
Number of reflections	37104	26	2534
<I/σ(I)>	15.33	29.47	1.37
Completeness [%]	96.2	83.9	78.2
Redundancy	7.266	7.462	2.048
CC(1/2)	0.998	1.000	0.622

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293.15	PEG 8000, Sodium citrate, Sodium Phosphate