3TW3

Crystal structure of RtcA.ATP.Co ternary complex

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS BEAMLINE X25
Synchrotron site	NSLS
Beamline	X25
Temperature [K]	130
Detector technology	PIXEL
Collection date	2011-04-30
Detector	DECTRIS PILATUS 6M
Wavelength(s)	1.6051
Spacegroup name	P 21 21 2
Unit cell lengths	69.660, 82.950, 51.780
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	32.371 - 2.100
R-factor	0.2096
Rwork	0.207
R-free	0.26320
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3kgd
RMSD bond length	0.007
RMSD bond angle	0.845
Data reduction software	MOSFLM
Data scaling software	SCALA
Phasing software	PHENIX
Refinement software	PHENIX ((phenix.refine: dev_833))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	32.371	2.210
High resolution limit [Å]	2.100	2.100
Number of reflections	17859
Completeness [%]	98.4	90

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.5	293	28 % PEG 5000 MME, 150 mM Ammonium sulfate, 100mM MES pH 6.5, 10 mM ATP, 20 mM Cobalt chloride, VAPOR DIFFUSION, HANGING DROP, temperature 293K