1AMX

COLLAGEN-BINDING DOMAIN FROM A STAPHYLOCOCCUS AUREUS ADHESIN

Experimental procedure

Source type	ROTATING ANODE
Source details	RIGAKU RUH3R
Temperature [K]	293
Detector technology	AREA DETECTOR
Collection date	1995-11
Detector	SIEMENS
Spacegroup name	P 32 2 1
Unit cell lengths	74.000, 74.000, 56.700
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	10.000 - 2.000
R-factor	0.2
Rwork	0.200
R-free	0.24900
Structure solution method	MIR
RMSD bond length	0.012
RMSD bond angle	28.600 *
Data reduction software	X-GEN ((MSI))
Data scaling software	X-GEN ((MSI))
Phasing software	PHASES
Refinement software	XTALVIEW

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	30.000	2.125
High resolution limit [Å]	2.000	2.000
Rmerge	0.078 *	0.308 *
Total number of observations	102943 *
Number of reflections	12250
<I/σ(I)>	10.6	2
Completeness [%]	98.3	89.7
Redundancy	8.4	4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	Vapor diffusion, hanging drop *	6.7		pH 6.7

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	reservoir	PEG4000	20-25 (%)
2	1	reservoir	HEPES	50 (mM)
3	1	reservoir	detergent n-octyl-beta-D-glucopyranoside	2-3 (%)