5YGK

Crystal structure of a synthase from Streptomyces sp. CL190 with dmaspp

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSRRC BEAMLINE TPS 05A
Synchrotron site	NSRRC
Beamline	TPS 05A
Temperature [K]	100
Detector technology	CCD
Collection date	2017-09-10
Detector	RAYONIX MX300-HS
Wavelength(s)	0.9998
Spacegroup name	P 1 21 1
Unit cell lengths	90.090, 119.308, 93.133
Unit cell angles	90.00, 117.35, 90.00

Refinement procedure

Resolution	24.866 - 2.047
R-factor	0.1853
Rwork	0.184
R-free	0.23570
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5xk3
RMSD bond length	0.009
RMSD bond angle	1.445
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX ((1.10_2155: ???))

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	25.000	25.000	2.120
High resolution limit [Å]	2.047	4.410	2.050
Rmerge	0.055	0.032	0.499
Rmeas	0.061	0.035	0.554
Rpim	0.026	0.015	0.236
Number of reflections	109264	11073	10800
<I/σ(I)>	9.8
Completeness [%]	99.7	99.6	99
Redundancy	5.3	5.3	5
CC(1/2)		0.999	0.892

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.5	298	NaAc, NaCl HEPES, PEG 3350