4AIN

Crystal structure of BetP with asymmetric protomers.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X10SA
Synchrotron site	SLS
Beamline	X10SA
Temperature [K]	100
Detector technology	CCD
Detector	ADSC CCD
Spacegroup name	P 21 21 21
Unit cell lengths	112.810, 128.150, 159.690
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	48.140 - 3.100
R-factor	0.2285
Rwork	0.225
R-free	0.28490
Structure solution method	OTHER
Starting model (for MR)	NONE
RMSD bond length	0.003
RMSD bond angle	0.643
Data reduction software	XDS
Data scaling software	XSCALE
Refinement software	PHENIX ((PHENIX.REFINE: 1.6_289))

Data quality characteristics

	Overall
Low resolution limit [Å]	48.000
High resolution limit [Å]	3.100
Rmerge	0.260
Number of reflections	42200
<I/σ(I)>	8.4
Completeness [%]	99.1
Redundancy	4.05

Crystallization Conditions

crystal ID	method	pH	temperature	details
1		5.5		pH 5.5