6PQ1

Structure of the Fremyella diplosiphon OCP1

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 5.0.2
Synchrotron site	ALS
Beamline	5.0.2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-04-14
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	1.0000
Spacegroup name	P 32 2 1
Unit cell lengths	95.019, 95.019, 78.523
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	41.140 - 1.610
R-factor	0.1956
Rwork	0.195
R-free	0.21280
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3mg1
RMSD bond length	0.018
RMSD bond angle	1.569
Data reduction software	XDS
Data scaling software	SCALA
Phasing software	PHENIX
Refinement software	PHENIX (1.16_3549)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	41.140	1.700
High resolution limit [Å]	1.610	1.610
Rmerge	0.037	0.385
Number of reflections	51011	7600
<I/σ(I)>	27.9	5
Completeness [%]	96.0	99.3
Redundancy	9.5	9.6
CC(1/2)	1.000	0.953

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	BATCH MODE	7	277	0.75 M potassium phosphate