9Z3B

Structure C-terminal human Mesothelin Peptide bound to MSLNB703 Fab

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 17-ID
Synchrotron site	APS
Beamline	17-ID
Temperature [K]	100
Detector technology	PIXEL
Collection date	2022-09-22
Detector	DECTRIS EIGER2 X 9M
Wavelength(s)	1
Spacegroup name	P 1
Unit cell lengths	60.151, 79.744, 86.774
Unit cell angles	77.18, 89.73, 89.84

Refinement procedure

Resolution	44.210 - 1.960
R-factor	0.2294
Rwork	0.227
R-free	0.27750
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.006
RMSD bond angle	0.885
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX ((1.19.2_4158: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	84.610	2.160
High resolution limit [Å]	1.960	1.960
Rmerge	0.091
Rmeas	0.129	1.612
Number of reflections	84396	32112
<I/σ(I)>	1.92
Completeness [%]	75.2	96.4
Redundancy	3.65	2.93
CC(1/2)	0.991	0.307

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	30% PEG1500