7Q73

Structure of Pla1 apo

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PETRA III, EMBL c/o DESY BEAMLINE P13 (MX1)
Synchrotron site	PETRA III, EMBL c/o DESY
Beamline	P13 (MX1)
Temperature [K]	100
Detector technology	PIXEL
Collection date	2019-03-25
Detector	DECTRIS PILATUS 6M-F
Wavelength(s)	0.9762
Spacegroup name	C 1 2 1
Unit cell lengths	122.060, 66.750, 88.120
Unit cell angles	90.00, 118.17, 90.00

Refinement procedure

Resolution	77.679 - 1.900
R-factor	0.1702
Rwork	0.169
R-free	0.19230
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2hhp
RMSD bond length	0.003
RMSD bond angle	0.550
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX (1.12)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	77.679	77.679	1.950
High resolution limit [Å]	1.900	8.500	1.900
Rmerge	0.112	0.031	1.232
Rmeas	0.122	0.034	1.336
Total number of observations	333356
Number of reflections	49224	587	3580
<I/σ(I)>	11.64	41.92	1.58
Completeness [%]	99.5	98.3	98.6
Redundancy	6.772	6.298	6.697
CC(1/2)	0.998	0.999	0.652

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.5	277	0.2 M lithium citrate, 20% PEG 3350