9SYQ

Structure of S. pombe Pta1 - Ssu72 - PNUTS - Swd2.2 complex - crystal form 1

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I04
Synchrotron site	Diamond
Beamline	I04
Temperature [K]	100
Detector technology	PIXEL
Collection date	2024-02-14
Detector	DECTRIS EIGER2 XE 16M
Wavelength(s)	0.95373
Spacegroup name	P 41 21 2
Unit cell lengths	217.037, 217.037, 189.918
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	71.460 - 3.790
R-factor	0.2268
Rwork	0.224
R-free	0.28010
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.003
RMSD bond angle	0.529
Data reduction software	autoPROC
Data scaling software	STARANISO
Phasing software	PHENIX (1.21_5207)
Refinement software	PHENIX (1.21_5207)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	142.924	4.050
High resolution limit [Å]	3.790	3.790
Rmerge	0.261	2.660
Rmeas	0.266	2.714
Rpim	0.051	0.527
Number of reflections	37954	1898
<I/σ(I)>	9.1	1.5
Completeness [%]	96.0	64
Redundancy	27.2	25.9
CC(1/2)	0.999	0.597

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293.15	10% PEG 8,000, 20% 1,5-pentanediol, 0.5 mM Lanthanides, 0.1 M MOPSO/bis-tris pH 6.5