7DQH

E. coli GyrB ATPase domain in complex with 2-hydroxybenzamide

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL19U1
Synchrotron site	SSRF
Beamline	BL19U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-12-18
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.97907
Spacegroup name	P 21 21 21
Unit cell lengths	61.517, 67.646, 102.280
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	56.420 - 1.910
R-factor	0.2025
Rwork	0.201
R-free	0.23445
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5z9b
RMSD bond length	0.024
RMSD bond angle	1.996
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	MOLREP
Refinement software	REFMAC (5.8.0158)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	56.420	2.030
High resolution limit [Å]	1.910	2.000
Number of reflections	33972	1660
<I/σ(I)>	30.349
Completeness [%]	99.8
Redundancy	6.4
CC(1/2)	0.965	0.888

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		298	0.1 M Tris-HCl pH 7.5, 2.20 M (NH4)2HPO4, 10 mM 2-aminobenzimidazole