7YLR

Structure of a bacteria protein

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL18U1
Synchrotron site	SSRF
Beamline	BL18U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-11-21
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.979
Spacegroup name	P 21 21 21
Unit cell lengths	47.217, 84.042, 87.864
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	41.590 - 1.680
R-factor	0.179
Rwork	0.177
R-free	0.20950
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	Alphafold2
RMSD bond length	0.007
RMSD bond angle	0.967
Data reduction software	autoPROC
Data scaling software	autoPROC
Phasing software	PHENIX (1.20_4459)
Refinement software	PHENIX (1.20_4459)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	60.730	1.740
High resolution limit [Å]	1.680	1.680
Number of reflections	37364	2363
<I/σ(I)>	18.4
Completeness [%]	91.8
Redundancy	11.1
CC(1/2)	0.999	0.894

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	LIQUID DIFFUSION		291.15	BIS-TRIS propane, Sodium malonate, Calcium chloride dihydrate