5Y7M

Crystal structure of PhoRpp38 bound to a K-turn in P12.1 helix

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SPRING-8 BEAMLINE BL26B1
Synchrotron site	SPring-8
Beamline	BL26B1
Temperature [K]	100
Detector technology	CCD
Collection date	2017-07-03
Detector	RAYONIX MX-225
Wavelength(s)	1
Spacegroup name	C 1 2 1
Unit cell lengths	113.370, 176.600, 59.900
Unit cell angles	90.00, 105.12, 90.00

Refinement procedure

Resolution	48.376 - 3.100
R-factor	0.2261
Rwork	0.225
R-free	0.24720
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2czw
RMSD bond length	0.001
RMSD bond angle	0.465
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX (1.10.1_2155)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	48.376	48.376	3.290
High resolution limit [Å]	3.100	9.150	3.100
Rmerge	0.197	0.041	0.744
Rmeas	0.229	0.048	0.867
Total number of observations	78285
Number of reflections	20596	820	3303
<I/σ(I)>	7.05	24.89	1.96
Completeness [%]	99.7	98.2	99.5
Redundancy	3.801	3.598	3.819
CC(1/2)	0.988	0.998	0.928

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6	293	sodium cacodylate ammonium solfate magnesium acetate