7SKD

Myocilin OLF mutant S331L

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 22-ID
Synchrotron site	APS
Beamline	22-ID
Temperature [K]	80
Detector technology	PIXEL
Collection date	2021-04-20
Detector	DECTRIS EIGER X 16M
Wavelength(s)	1.0
Spacegroup name	P 1 21 1
Unit cell lengths	49.180, 50.600, 50.280
Unit cell angles	90.00, 97.15, 90.00

Refinement procedure

Resolution	35.130 - 1.712
R-factor	0.232
Rwork	0.227
R-free	0.28200
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6pke
RMSD bond length	0.007
RMSD bond angle	0.889
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX (1.17.1_3660)
Refinement software	PHENIX (1.17.1_3660)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	35.130	1.773
High resolution limit [Å]	1.712	1.712
Rmerge	0.097	0.314
Rmeas	0.106	0.357
Rpim	0.043	0.167
Number of reflections	21742	1000
<I/σ(I)>	10.58	2.24
Completeness [%]	80.8	37.78
Redundancy	6.1	4.3
CC(1/2)	0.992	0.934

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.2	289	10% PEG 8000, 0.05M magnesium chloride