9VSO

Crystal structure of Fab bound to the WT1-derived RMF peptide presented by HLA-A*02:01

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 5C (4A)
Synchrotron site	PAL/PLS
Beamline	5C (4A)
Temperature [K]	295.15
Detector technology	PIXEL
Collection date	2024-07-27
Detector	DECTRIS EIGER X 9M
Wavelength(s)	1.0
Spacegroup name	P 21 21 21
Unit cell lengths	101.070, 132.810, 185.660
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	29.920 - 3.030
R-factor	0.1851
Rwork	0.183
R-free	0.23380
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.013
RMSD bond angle	1.397
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX (1.17.1_3660)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	29.920	3.138
High resolution limit [Å]	3.030	3.030
Number of reflections	49217	49214
<I/σ(I)>	16.9
Completeness [%]	99.8
Redundancy	13.5
CC(1/2)	0.998	0.990

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		295.15	8% (w/v) PEG 5000 MME, 5% (v/v) Tacsimate TM (pH 7.0), 100mM HEPES (pH 7.0)