9PGY

Crystal structure of STEAP2 N-domain in complex with NADPH

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRL BEAMLINE BL9-2
Synchrotron site	SSRL
Beamline	BL9-2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2024-11-14
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.97946
Spacegroup name	P 31 2 1
Unit cell lengths	68.218, 68.218, 95.398
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	29.540 - 1.550
R-factor	0.1933
Rwork	0.193
R-free	0.19960
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.007
RMSD bond angle	1.170
Data reduction software	DENZO
Data scaling software	HKL-3000
Phasing software	PHENIX
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	1.580
High resolution limit [Å]	1.550	4.210	1.550
Rmerge	0.093	0.026	1.808
Rmeas	0.099	0.027	1.903
Rpim	0.031	0.009	0.590
Total number of observations	364703
Number of reflections	37869	2047	1832
<I/σ(I)>	7.2
Completeness [%]	100.0	99.6	100
Redundancy	9.6	9.2	10
CC(1/2)	0.995	1.000	0.471

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		295	0.1 M Bis-Tris pH 5.5, 2.0 M ammonium sulfate