1ERW

HUMAN THIOREDOXIN DOUBLE MUTANT WITH CYS 32 REPLACED BY SER AND CYS 35 REPLACED BY SER

Experimental procedure

Detector technology	DIFFRACTOMETER
Collection date	1995-04-20
Detector	ENRAF-NONIUS FAST
Spacegroup name	C 1 2 1
Unit cell lengths	67.770, 26.380, 51.640
Unit cell angles	90.00, 95.08, 90.00

Refinement procedure

Resolution	15.000 - 1.800
R-factor	0.21
Rwork	0.210
R-free	0.26000
RMSD bond length	0.016
RMSD bond angle	25.300 *
Data reduction software	MADNES
Phasing software	X-PLOR (3.1)
Refinement software	X-PLOR (3.1)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	35.000
High resolution limit [Å]	1.800
Rmerge	0.044
Total number of observations	23947 *
Number of reflections	7917
Completeness [%]	91.0	77 *
Redundancy	3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	Vapor diffusion, hanging drop *	3.8 *

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	drop	sodium acetate	10 (mM)
2	1	drop	MPD	25 (%(v/v))
3	1	drop	dithiothreitol	5 (mM)
4	1	reservoir	sodium acetate	10 (mM)
5	1	reservoir	MPD	50 (%(v/v))
6	1	reservoir	dithiothreitol	5 (mM)