3GF3

Glutaconyl-coA decarboxylase A subunit from Clostridium symbiosum co-crystallized with glutaconyl-coA

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	ENRAF-NONIUS FR591
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	2008-08-08
Detector	MAR scanner 345 mm plate
Wavelength(s)	1.54179
Spacegroup name	F 2 2 2
Unit cell lengths	102.360, 144.360, 167.150
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	36.150 - 1.750
R-factor	0.163
Rwork	0.163
R-free	0.17600
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1pix
RMSD bond length	0.008
RMSD bond angle	1.173
Data reduction software	MOSFLM
Data scaling software	SCALA (3.2.25)
Phasing software	MOLREP
Refinement software	REFMAC

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	37.349	37.350	1.840
High resolution limit [Å]	1.750	5.530	1.750
Rmerge	0.046	0.029	0.262
Total number of observations		7860	33572
Number of reflections	60672
<I/σ(I)>	10.391	16.5	2.9
Completeness [%]	97.9	89.9	99.7
Redundancy	3.9	4.3	3.7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1