6J72

Crystal structure of IniA from Mycobacterium smegmatis with GTP bound

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL18U1
Synchrotron site	SSRF
Beamline	BL18U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2016-03-14
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.97791
Spacegroup name	P 64
Unit cell lengths	91.514, 91.514, 139.494
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	46.498 - 2.200
R-factor	0.1865
Rwork	0.185
R-free	0.22110
Structure solution method	SAD
RMSD bond length	0.004
RMSD bond angle	0.844
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX (1.9_1692)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	2.240
High resolution limit [Å]	2.200	5.970	2.200
Rmerge	0.131	0.093	0.539
Rmeas	0.134	0.096	0.552
Rpim	0.030	0.022	0.120
Number of reflections	33615	1732	1670
<I/σ(I)>	3.6
Completeness [%]	100.0	100	100
Redundancy	20.6	20.1	21.2
CC(1/2)		0.996	0.958

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		289	AAA