2J92

3C PROTEASE FROM TYPE A10(61) FOOT-AND-MOUTH DISEASE VIRUS - Crystal packing mutant (K51Q)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SRS BEAMLINE PX10.1
Synchrotron site	SRS
Beamline	PX10.1
Temperature [K]	100
Detector technology	CCD
Collection date	2005-12-15
Detector	MARRESEARCH
Spacegroup name	P 21 21 21
Unit cell lengths	59.387, 71.708, 92.399
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	23.590 - 2.200
R-factor	0.229
Rwork	0.229
R-free	0.25400
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2bhg
RMSD bond length	0.005
RMSD bond angle	1.000
Data reduction software	MOSFLM
Data scaling software	SCALA
Phasing software	PHASER
Refinement software	CNS (1.1)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	23.600	2.320
High resolution limit [Å]	2.200	2.200
Rmerge	0.080	0.340
Number of reflections	20590
<I/σ(I)>	11.6	3.8
Completeness [%]	99.7	99.5
Redundancy	3.5	3.5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1		7		SEE PAPER, pH 7.00