7UVN

Crystal structure of human ClpP protease in complex with TR-57

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	CLSI BEAMLINE 08B1-1
Synchrotron site	CLSI
Beamline	08B1-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2019-08-03
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.98
Spacegroup name	C 1 2 1
Unit cell lengths	142.098, 153.040, 104.696
Unit cell angles	90.00, 117.92, 90.00

Refinement procedure

Resolution	49.250 - 3.110
R-factor	0.232
Rwork	0.229
R-free	0.28300
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6bba
Data reduction software	MOSFLM
Data scaling software	Aimless
Phasing software	PHENIX
Refinement software	PHENIX (1.20)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	3.150
High resolution limit [Å]	3.100	8.400	3.100
Rmerge	0.285	0.103	1.065
Rmeas	0.307	0.111	1.146
Rpim	0.113	0.041	0.419
Total number of observations	253214
Number of reflections	35316	1818	1762
<I/σ(I)>	2.6
Completeness [%]	99.7	99.9	99.4
Redundancy	7.2	7.1	7.3
CC(1/2)		0.996	0.705

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		294	0.1 M sodium acetate, pH 4.6 to 5.2, 5 % PEG 4000