6IQU

Crystal structure of Prc with PDZ domain deletion in complex with NlpI

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSRRC BEAMLINE TPS 05A
Synchrotron site	NSRRC
Beamline	TPS 05A
Temperature [K]	110
Detector technology	CCD
Collection date	2018-09-19
Detector	RAYONIX MX300HE
Wavelength(s)	0.99984
Spacegroup name	C 2 2 21
Unit cell lengths	105.827, 151.082, 148.380
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	38.800 - 2.900
R-factor	0.19398
Rwork	0.192
R-free	0.23340
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5wql
RMSD bond length	0.010
RMSD bond angle	1.765
Data reduction software	HKL-2000
Data scaling software	HKL-2000 (V712)
Phasing software	PHASER (2.70)
Refinement software	REFMAC (5.8.0232)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	3.000
High resolution limit [Å]	2.900	2.900
Rmerge	0.057	0.201
Rmeas	0.088	0.276
Rpim	0.042	0.141
Number of reflections	25531	1987
<I/σ(I)>	18.95	4.39
Completeness [%]	95.9	76
Redundancy	4.4	3.4
CC(1/2)		0.963

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		289	PEG3350, sodium citrate tribasic dihydrate