7CO7

HtrA-type protease AlgWS227A with decapeptide

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	2019-09-20
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.97853
Spacegroup name	F 2 3
Unit cell lengths	179.100, 179.100, 179.100
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	34.470 - 2.600
R-factor	0.2014
Rwork	0.197
R-free	0.23830
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1soz
RMSD bond length	0.009
RMSD bond angle	1.166
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX (1.13_2998)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	34.470	2.694
High resolution limit [Å]	2.600	2.600
Number of reflections	28555	1500
<I/σ(I)>	22.53
Completeness [%]	100.0
Redundancy	30.3
CC(1/2)	1.000	0.146

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	10.5	290	30% PEG 400, 100mM CAPS/Sodium hydrochloric PH 10.5