5EHW

human carbonic anhydrase II in complex with ligand

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	AUSTRALIAN SYNCHROTRON BEAMLINE MX2
Synchrotron site	Australian Synchrotron
Beamline	MX2
Temperature [K]	100
Detector technology	CCD
Collection date	2015-06-09
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.99
Spacegroup name	P 1 21 1
Unit cell lengths	42.280, 41.699, 72.344
Unit cell angles	90.00, 103.95, 90.00

Refinement procedure

Resolution	39.860 - 1.392
R-factor	0.1521
Rwork	0.151
R-free	0.16850
RMSD bond length	0.008
RMSD bond angle	1.201
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.9_1692)

Data quality characteristics

	Overall
Low resolution limit [Å]	41.700
High resolution limit [Å]	1.392
Number of reflections	49135
<I/σ(I)>	11.3
Completeness [%]	99.7
Redundancy	6.1

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		280	ammonium sulfate, tris-chloride