9DSC

Crystal structure of Apo-241_2F04-A95a mutant Fab

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS-II BEAMLINE 17-ID-1
Synchrotron site	NSLS-II
Beamline	17-ID-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2024-02-02
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.9183
Spacegroup name	P 21 21 21
Unit cell lengths	64.254, 113.659, 160.812
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	46.410 - 2.010
R-factor	0.2015
Rwork	0.200
R-free	0.23640
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.002
RMSD bond angle	0.590
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX ((1.20.1_4487: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.030
High resolution limit [Å]	2.000	2.000
Rmerge	0.140	1.200
Rpim	0.040	0.380
Number of reflections	76548	76269
<I/σ(I)>	12
Completeness [%]	100.0
Redundancy	12.9
CC(1/2)	1.000	0.400

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	0.2 M potassium acetate, pH 6.3, 18% PEG3350