8SPG

Crystal structure of N-terminally truncated Escherichia coli RapA in complex with MgADP

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 22-ID
Synchrotron site	APS
Beamline	22-ID
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-07-20
Detector	DECTRIS EIGER X 16M
Wavelength(s)	1.0
Spacegroup name	P 21 21 21
Unit cell lengths	65.567, 82.099, 188.546
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	29.350 - 2.100
R-factor	0.1987
Rwork	0.198
R-free	0.23600
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.007
RMSD bond angle	0.862
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	PHASER
Refinement software	PHENIX ((1.20.1_4487: ???))

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	30.000	30.000	2.180
High resolution limit [Å]	2.100	4.520	2.100
Rmerge	0.125	0.040	1.603
Rmeas	0.132	0.042	1.700
Rpim	0.044	0.014	0.562
Total number of observations	542802
Number of reflections	60199	6365	5897
<I/σ(I)>	6.5
Completeness [%]	99.9	99.9	100
Redundancy	9	8.4	9.1
CC(1/2)	0.998	0.999	0.498

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8	293	PEG3360