3VYR

Crystal structure of the HypC-HypD complex

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SPRING-8 BEAMLINE BL41XU
Synchrotron site	SPring-8
Beamline	BL41XU
Temperature [K]	100
Detector technology	CCD
Collection date	2008-04-13
Detector	ADSC QUANTUM 315r
Wavelength(s)	1.0000
Spacegroup name	P 3 2 1
Unit cell lengths	181.179, 181.179, 49.433
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	45.300 - 2.550
R-factor	0.17
Rwork	0.170
R-free	0.21200
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2z2c 2z1d
RMSD bond length	0.014
RMSD bond angle	1.700
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	MOLREP
Refinement software	CNS (1.2)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.640
High resolution limit [Å]	2.550	2.550
Number of reflections	30506
<I/σ(I)>	23.1	3.8
Completeness [%]	100.0	100
Redundancy	6.7	6.5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	4.7	293	1.4M (NH4)3 citrate/citric acid(pH 4.5-4.7), 0.7% 2-methyl-2,4-pentandiol, VAPOR DIFFUSION, SITTING DROP, temperature 293K