8W7X

SPS_Carbonic Anhydrases

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 5C (4A)
Synchrotron site	PAL/PLS
Beamline	5C (4A)
Temperature [K]	100
Detector technology	CCD
Collection date	2021-11-29
Detector	ADSC QUANTUM 315r
Wavelength(s)	1.0
Spacegroup name	P 31
Unit cell lengths	92.414, 92.414, 148.059
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	33.730 - 2.200
R-factor	0.1672
Rwork	0.166
R-free	0.19980
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4x5s
RMSD bond length	0.008
RMSD bond angle	0.931
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX ((1.17.1_3660: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	42.000	2.280
High resolution limit [Å]	2.200	2.200
Number of reflections	71625	7087
<I/σ(I)>	9.06
Completeness [%]	99.0
Redundancy	4.3
CC(1/2)	0.939	0.971

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	PEG 4000 Ammonium Sulfate Sodium Acetate pH4.6