1BF5

TYROSINE PHOSPHORYLATED STAT-1/DNA COMPLEX

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	CHESS BEAMLINE A1
Synchrotron site	CHESS
Beamline	A1
Temperature [K]	100
Detector technology	AREA DETECTOR
Collection date	1998-01-02
Spacegroup name	C 2 2 21
Unit cell lengths	76.600, 148.200, 181.100
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	30.000 - 2.900
R-factor	0.227
Rwork	0.227
R-free	0.29300
Structure solution method	MIR
RMSD bond length	0.018
RMSD bond angle	2.289 *
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	SHARP
Refinement software	CNS (3.0)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	30.000
High resolution limit [Å]	2.900	2.900 *
Rmerge	0.075	0.198 *
Total number of observations	261200 *
Number of reflections	23301
Completeness [%]	89.8	72.1 *
Redundancy	11.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	5	4 *	pH 5.00, VAPOR DIFFUSION, HANGING DROP, temperature 277.00K

Crystallization Reagents

ID	crystal ID	solution ID	reagent name	concentration	details
1	1	1	WATER
10	1	2	MGCL2
11	1	2	KCL
12	1	2	NA ACETATE
2	1	1	NA ACETATE
3	1	1	KCL
4	1	1	MGCL2
5	1	1	NAN3
6	1	1	PEG 400
7	1	2	WATER
8	1	2	PEG 400
9	1	2	NAN3

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	drop	protein	0.12 (mM)
2	1	reservoir	sodium acetate	100 (mM)	pH5.0
3	1	reservoir		100 (mM)
4	1	reservoir		20 (mM)
5	1	reservoir	PEG400	3 (%)
6	1	reservoir		0.01 (%)