9RXO

Structure of the PDZ2 domain from human PDZK1 (NHERF3) with the C-terminal residues (KSTQF) of human URAT1 transporter (SLC22A12)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID23-1
Synchrotron site	ESRF
Beamline	ID23-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2023-05-23
Detector	DECTRIS EIGER2 X CdTe 16M
Wavelength(s)	0.95373
Spacegroup name	P 21 21 21
Unit cell lengths	32.618, 39.105, 137.795
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	34.450 - 1.200
R-factor	0.1675
Rwork	0.166
R-free	0.20350
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.009
RMSD bond angle	1.037
Data reduction software	autoPROC
Data scaling software	STARANISO (2.4.9)
Phasing software	PHASER (2.8.3)
Refinement software	PHENIX (1.21_5207)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	35.000	1.240
High resolution limit [Å]	1.200	1.200
Rmerge	0.085	1.415
Rpim	0.028	0.479
Number of reflections	49076	2304
<I/σ(I)>	12.1	2.1
Completeness [%]	94.1
Redundancy	10.1
CC(1/2)	0.992	0.562

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	26% PEG 1500