5KOZ

Structure function studies of R. palustris RubisCO (K192C mutant; CABP-bound)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 24-ID-C
Synchrotron site	APS
Beamline	24-ID-C
Temperature [K]	100
Detector technology	PIXEL
Collection date	2016-03-22
Detector	DECTRIS PILATUS 6M-F
Wavelength(s)	0.9795
Spacegroup name	P 1
Unit cell lengths	75.460, 110.620, 166.850
Unit cell angles	89.96, 101.77, 104.88

Refinement procedure

Resolution	11.495 - 2.300
R-factor	0.205
Rwork	0.200
R-free	0.24670
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4lf1
RMSD bond length	0.002
RMSD bond angle	0.527
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX ((dev_2420: ???))

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	87.160	87.160	2.360
High resolution limit [Å]	2.300	10.290	2.300
Rmerge	0.091	0.033	0.575
Number of reflections	209573
<I/σ(I)>	6.91	17.14	1.68
Completeness [%]	92.5	98.5	94
Redundancy	2.6
CC(1/2)	0.995	0.998	0.849

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.5	291	protein storage buffer: 20 mM Tris, pH 8.0, 300 mM NaCl, 10% Glycerol, 10 mM MgCl2, 20 mM NaHCO3. Reservoir solution: 20-24% PEG 3350, 200 mM Sodium sulfate, 100 mM Bis-Tris Propane pH 7.0-8.0.