9K2K

Structure of ClpP from Staphylococcus aureus in complex with ZY7

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL19U1
Synchrotron site	SSRF
Beamline	BL19U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-06-06
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.988
Spacegroup name	P 21 21 21
Unit cell lengths	96.368, 174.507, 194.455
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	129.880 - 2.740
R-factor	0.22678
Rwork	0.226
R-free	0.24868
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.011
RMSD bond angle	1.644
Data reduction software	autoPROC
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	REFMAC (5.8.0135)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	129.880	30.000	2.850
High resolution limit [Å]	2.740	5.910	2.750
Rmerge	0.079	0.056	0.273
Rmeas	0.088	0.061	0.336
Rpim	0.039	0.024	0.190
Number of reflections	62269	6551	5356
<I/σ(I)>	11.8
Completeness [%]	92.4	98.4	82.2
Redundancy	4	5.8	2.4
CC(1/2)	0.993	0.998	0.566

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		289	0.1 M Sodium chloride, 0.1 M BICINE pH9.0, 20% PEG monomethyl ether 550