5ZW3

Crystal Structure of TrmR from B. subtilis

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 7A (6B, 6C1)
Synchrotron site	PAL/PLS
Beamline	7A (6B, 6C1)
Temperature [K]	100
Detector technology	CCD
Collection date	2017-05-19
Detector	ADSC QUANTUM 270
Wavelength(s)	0.9793
Spacegroup name	P 21 21 2
Unit cell lengths	76.874, 116.738, 43.437
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	30.000 - 2.270
R-factor	0.2156
Rwork	0.213
R-free	0.26610
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2gpy
RMSD bond length	0.001
RMSD bond angle	0.415
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	MOLREP
Refinement software	REFMAC (5.8.0158)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	2.310
High resolution limit [Å]	2.270	6.160	2.270
Rmerge	0.091	0.060	0.413
Rmeas	0.100	0.067	0.462
Rpim	0.040	0.028	0.202
Total number of observations	113363
Number of reflections	18494	949	878
<I/σ(I)>	8.4
Completeness [%]	99.2	90.7	97.6
Redundancy	6.1	5.5	5.1
CC(1/2)		0.997	0.976

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7	293	1.1 M Ammonium tartrate dibasic (pH 7.0)