12PG

GII.3 P-domain in complex with M6 Nanobody

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 8.2.2
Synchrotron site	ALS
Beamline	8.2.2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2023-12-21
Detector	DECTRIS PILATUS3 S 2M
Wavelength(s)	1.00002
Spacegroup name	P 61 2 2
Unit cell lengths	87.300, 87.300, 225.830
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	45.240 - 2.200
R-factor	0.203
Rwork	0.202
R-free	0.23010
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.004
RMSD bond angle	0.654
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX (1.21.2_5419)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	45.240	2.240
High resolution limit [Å]	2.200	2.200
Rmerge	0.139	0.785
Number of reflections	26770	1307
<I/σ(I)>	14.8
Completeness [%]	100.0
Redundancy	30

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		298	300mM succinic acid 100mM citric acid NaOH, pH 3.5 22.5% PurePEGs cocktail 10mM phenol