6PKD

Myocilin OLF mutant N428D/D478H

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 22-ID
Synchrotron site	APS
Beamline	22-ID
Temperature [K]	100
Detector technology	PIXEL
Collection date	2019-03-07
Detector	DECTRIS EIGER X 16M
Wavelength(s)	1
Spacegroup name	P 1 21 1
Unit cell lengths	48.547, 47.342, 97.076
Unit cell angles	90.00, 100.20, 90.00

Refinement procedure

Resolution	33.630 - 1.900
R-factor	0.1834
Rwork	0.182
R-free	0.20810
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	pdbid 6ou2
RMSD bond length	0.007
RMSD bond angle	0.880
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX (1.15.2_3472)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	1.930
High resolution limit [Å]	1.900	5.160	1.900
Rmerge	0.144	0.075	0.496
Rmeas	0.166	0.087	0.584
Rpim	0.081	0.043	0.301
Total number of observations	137258
Number of reflections	33873	1780	1688
<I/σ(I)>	6.4
Completeness [%]	98.6	98.5	96.6
Redundancy	4.1	4	3.5
CC(1/2)		0.993	0.666

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.5	289	PEG 8000, MgCl2