7WH5

Crystal structure of human ClpP in complex with ZG180

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL02U1
Synchrotron site	SSRF
Beamline	BL02U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-11-27
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.979
Spacegroup name	P 1 21 1
Unit cell lengths	111.890, 97.025, 131.420
Unit cell angles	90.00, 93.70, 90.00

Refinement procedure

Resolution	54.330 - 2.130
R-factor	0.2318
Rwork	0.230
R-free	0.24920
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1tg6
RMSD bond length	0.012
RMSD bond angle	1.644
Data reduction software	xia2
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	REFMAC (5.8.0158)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	54.380	54.380	2.190
High resolution limit [Å]	2.130	9.530	2.130
Rmerge	0.118	0.042	1.231
Number of reflections	156976	156976	156976
<I/σ(I)>	6
Completeness [%]	100.0	99.4	100
Redundancy	6.6	6.9	6.5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.5	289	0.2M Sodium malonate pH 5.0, 20% w/v Polyethylene glycol 3350