9S4G

Carbonic anhydrases from Candida parapsilosis

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	BESSY BEAMLINE 14.1
Synchrotron site	BESSY
Beamline	14.1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2022-09-05
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.9184
Spacegroup name	P 41 21 2
Unit cell lengths	118.788, 118.788, 188.214
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	41.050 - 2.701
R-factor	0.272
Rwork	0.272
R-free	0.32880
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.004
RMSD bond angle	0.819
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX (1.19.2_4158)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	41.050	2.798
High resolution limit [Å]	2.701	2.701
Number of reflections	35198	3693
<I/σ(I)>	15.96
Completeness [%]	93.1
Redundancy	1.99
CC(1/2)	1.000	0.712

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	5	294	0.1 M sodium acetate (pH 5.0), 7.5 % (w/v) PEG 6000, 20% glycerol w