1AYF

BOVINE ADRENODOXIN (OXIDIZED)

Experimental procedure

Source type	SYNCHROTRON
Source details	EMBL/DESY, HAMBURG BEAMLINE X11
Synchrotron site	EMBL/DESY, HAMBURG
Beamline	X11
Temperature [K]	123
Detector technology	IMAGE PLATE
Collection date	1997-03
Detector	MARRESEARCH
Spacegroup name	P 21 21 2
Unit cell lengths	44.180, 78.340, 60.600
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	11.000 - 1.850
R-factor	0.195 *
Rwork	0.195
R-free	0.25300
Structure solution method	MAD
RMSD bond length	0.012
RMSD bond angle	0.015
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	MLPHARE
Refinement software	CCP4

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	10.000 *	1.810
High resolution limit [Å]	1.750	1.750
Rmerge	0.044 *	0.204 *
Number of reflections	21775
<I/σ(I)>	30.956	7.74
Completeness [%]	99.9	99.1
Redundancy	5	5.0 *

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	Vapor diffusion, hanging drop *	7.3 *	4 *	PROTEIN WAS CRYSTALLIZED FROM 30% PEG 4000, 10% GLYCEROL, 100 MM TRIS, PH 7.4, 100MM MGCL2, 20 MG/ML PROTEIN

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	drop	protein	20 (mg/ml)
2	1	reservoir	PEG4000	30 (%(w/v))
3	1	reservoir	Tris-HCl	100 (mM)
4	1	reservoir	glycerol	10 (%)
5	1	reservoir		100 (mM)