1D5W

PHOSPHORYLATED FIXJ RECEIVER DOMAIN

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID14-3
Synchrotron site	ESRF
Beamline	ID14-3
Temperature [K]	100
Detector technology	CCD
Collection date	1998-09-19
Detector	MARRESEARCH
Spacegroup name	C 1 2 1
Unit cell lengths	132.150, 91.300, 59.880
Unit cell angles	90.00, 112.45, 90.00

Refinement procedure

Resolution	24.500 - 2.300
R-factor	0.218
Rwork	0.217
R-free	0.24400
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.009
RMSD bond angle	22.300 *
Data reduction software	MOSFLM
Data scaling software	CCP4 ((SCALA))
Phasing software	AMoRE
Refinement software	CNS (0.5)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	24.500	2.420
High resolution limit [Å]	2.300	2.300
Rmerge	0.050	0.155
Total number of observations	83599 *
Number of reflections	26027
<I/σ(I)>	9.5	4.6
Completeness [%]	90.0	93
Redundancy	3.2	2.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7 *	4 *	drop was mixed with an equal volume of reservoir solution *
1	VAPOR DIFFUSION, HANGING DROP	7 *	4 *	drop was mixed with an equal volume of reservoir solution *

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	drop	protein	12 (mg/ml)
2	1	drop	Tris-HCl	20 (mM)
3	1	drop	EDTA	0.1 (mM)
4	1	drop	dithiothreitol	1 (mM)
5	1	reservoir	PEG1500	40 (%(w/v))
6	1	reservoir	Tris-HCl	20 (mM)