7SQX

Crystal Structure of Pseudomonas aeruginosa lytic polysaccharide monooxygenase CbpD

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SOLEIL BEAMLINE PROXIMA 1
Synchrotron site	SOLEIL
Beamline	PROXIMA 1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2013-11-11
Detector	DECTRIS PILATUS 6M
Wavelength(s)	1.0087
Spacegroup name	P 31 1 2
Unit cell lengths	85.770, 85.770, 90.860
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	38.780 - 3.000
R-factor	0.2135
Rwork	0.210
R-free	0.24870
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	ab initio model
RMSD bond length	0.003
RMSD bond angle	0.572
Data scaling software	XSCALE (July 4, 2012)
Phasing software	PHASER (2.8.3)
Refinement software	PHENIX (1.19.2_4158)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	42.885	2.970
High resolution limit [Å]	2.900	2.900
Rmeas	0.154
Number of reflections	8655	642
<I/σ(I)>	11.87	1.36
Completeness [%]	100.0	100
Redundancy	11.2
CC(1/2)	0.997	0.568

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8	298	0.2 mM di-ammonium tartrate, 20% (w/v) PEG 3350, 20mM Tris, 100mM NaCl, pH 8