9LQD

Crystal structure of SAM lyase

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL10U2
Synchrotron site	SSRF
Beamline	BL10U2
Temperature [K]	153
Detector technology	PIXEL
Collection date	2024-04-20
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.97918
Spacegroup name	I 21 3
Unit cell lengths	118.060, 118.060, 118.060
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	27.830 - 2.160
R-factor	0.1982
Rwork	0.197
R-free	0.21270
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.007
RMSD bond angle	0.851
Data reduction software	xia2
Data scaling software	xia2
Phasing software	PHENIX
Refinement software	PHENIX ((1.21.1_5286: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	29.510	2.220
High resolution limit [Å]	2.160	2.160
Number of reflections	14829	1080
<I/σ(I)>	28.7
Completeness [%]	100.0
Redundancy	37.2	30.9
CC(1/2)	0.999	0.796

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7	277	2.1 M DL-Malic acid pH 7.0