6PKE

Myocilin OLF mutant N428E/D478S

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	48.222, 47.294, 97.020
Unit cell angles	90.00, 100.28, 90.00

Refinement procedure

Resolution	33.600 - 1.880
R-factor	0.1786
Rwork	0.176
R-free	0.21850
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	pdbid 6ou2
RMSD bond length	0.006
RMSD bond angle	0.774
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX (1.15.2_3472)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	1.910
High resolution limit [Å]	1.880	5.100	1.880
Rmerge	0.117	0.055	0.459
Rmeas	0.139	0.065	0.558
Rpim	0.073	0.033	0.312
Total number of observations	108492
Number of reflections	34580	1784	1641
<I/σ(I)>	5.9
Completeness [%]	97.8	95.9	95
Redundancy	3.1	3.2	2.8
CC(1/2)		0.997	0.693

Crystallization Conditions

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