3ZNJ

Crystal structure of unliganded ClcF from R.opacus 1CP in crystal form 1.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	BESSY BEAMLINE 14.2
Synchrotron site	BESSY
Beamline	14.2
Temperature [K]	100
Detector technology	CCD
Detector	MARRESEARCH
Spacegroup name	P 1 21 1
Unit cell lengths	151.140, 79.430, 198.970
Unit cell angles	90.00, 93.41, 90.00

Refinement procedure

Resolution	19.898 - 2.100
R-factor	0.1644
Rwork	0.164
R-free	0.22350
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1mli
RMSD bond length	0.003
RMSD bond angle	0.807
Data reduction software	MOSFLM
Data scaling software	SCALA
Phasing software	MOLREP
Refinement software	PHENIX ((PHENIX.REFINE: DEV_1172))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	20.000	2.210
High resolution limit [Å]	2.100	2.100
Rmerge	0.040	0.180
Number of reflections	261677
<I/σ(I)>	18.2	6.7
Completeness [%]	95.3	90
Redundancy	3.3	3.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1